Institute of Organic Chemistry

Polish Academy

 of Sciences

24th INFORMAL MEETING ON MASS SPECTROMETRY

14-18th May 2006, Ustroń, Poland

Polish Society for Mass Spectrometry

 

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Programme of the 24th IMMS

(final version - at least till the beginning of the meeting )

Saturday, May 13th  - Sunday, May 14th, 2006

Pre-conference tour to Kraków and Wieliczka

Sunday, May 14th, 2006

 

16:00 – 19:00

Registration

 

19:00 –

Get-together party

Monday, May 15th, 2006

 

8:15 – 8:45

Registration

 

8:45 – 9:00

Opening

 

Chaiman: K. Vékey

MoPl01

9:00 – 9:30

J.H. Futrell, J. Laskin, I. K. Chu

Collisional activation and dissociation of even- and odd-electron peptide ions

MoPl02

9:30 – 10:00

G. Allmaier, M. Zehl, R. Mistrik, O. Belgacem, E. Raptakis, E. Pittenauer

Comparison of CID-spectra of singly charged biomolecule precursor ions obtained by positive-ion vacuum MALDI IT/RTOF and TOF/CFR, AP-MALDI-IT and ESI-IT mass spectrometry

MoOr01

10:00 – 10:20

G. Grasso, G. Spoto, E. Rizzarelli, M. Fragai, K. Joo Yeo

In situ MALDI-MS characterization of MMPs anchored on gold surfaces

MoOr02

10:20 – 10:40

A. Jegorov, M. Hajduch, M. Sulc, V. Havlíček

Non-ribosomal cyclic peptides: specific markers of fungal infections

MoOr03

10:40 – 11:00

C. Lenz and V. Kruft

Detection and identification of analytes in complex mixtures: unique applications of hybrid triple quadrupole/linear ion trap mass spectrometry

 

11:00 – 11:30

Coffee break

 

Chairman: J.H. Futrell

MoPl03

11:30 – 12:00

R. Wu, T.B. McMahon

Proton transport isomerization in gas phase amino acids and peptides

MoOr04

12:00 – 12:20

M. Culea, N. Nanulescu

SIM-GC-MS method for liver function test

MoOr05

12:20 – 12:40

P. Mikulčíková, P. Van Eenoo, Wim Van Thuyne, K. Deventer, F. Delbeke

Excretion study after administration of three different progestins

MoOr06

12:40 – 13:00

E. Ragazzi, S. Pucciarelli, R. Seraglia, M. Agostini, M. Lise, P. Traldi, D. Nitti, L. Molin

Multivariate analysis to the plasma protein profile of patients with advanced colorectal cancer

 

13:00 – 14:00

Lunch

 

14:00 – 15:30

Poster session 1

 

Chairman: T.B. McMahon

MoPl04

15:30 – 16:00

J. Sikora, J. Poznański, T. Rubel, M. Bakun, A. Malinowska, M. Kotliński, K. Szczęsna, K. Karczmarski, M. Dadlez

LC-ESI MS-MS/MS analyses of complex protein sets

MoOr07

16:00 – 16:20

K. Nagy, A. Jakab, F. Pollreisz, L. Ceraulo, M.R. Averna, D. Noto, K. Vékey

A novel HPLC-MS method for analysis of plasma sterols

MoOr08

16:20 – 16:40

(Shim-Pol – representative of Shimadzu Corporation)

 

16:40 – 17:10

Coffee break

 

Chairman: G. Allmaier

MoPl05

17:10 – 17:40

M. Glocker

Molecular signatures of polygenic diseases - the role of mass
spectrometric proteome analysis in individualized medicine

MoPl06

17:40 – 18:10

J. Chmelík, J. Žídková, P. Řehulka, J. Bobáĺová

Full-coverage proteomic identification

MoOr09

18:10 – 18:30

L. Kolářová, M. Holčapek, P. Císař, M. Nobilis

HPLC/MS/MS in the analysis of drug metabolites

MoOr10

18:30 – 18:50

M. Kowalczuk, G. Adamus
High-throughput structural characterization of polyhydroxy¬alkanoates by mass spectrometry

 

20:00 -

Conference dinner

Tuesday, May 16th, 2006

 

 

Chairman: P.B. Armentrout

TuPl01

9:00 – 9:30

M.F. Bush, J. O’Brien, S. Krishnaswamy, E.R. Williams

Bridging solution and gas-phase chemistry with nanodrop mass spectrometry

TuPl02

9:30 – 10:00

F. De Angelis, S. Reale

Study of metal cations binding selectivity of ligands by ESI-MS

TuOr01

10:00 – 10:20

P.C. Burgers, J.J.A. van Kampen, R. de Groot, T.M. Luider, P.J.A. Ruttink

Quantitative analysis of pharmaceutical compounds by MALDI-TOF MS: mechanism for alkali ion attachment

TuOr02

10:20 – 10:40

A. Giuliani, O. Laprévote

Ion formation mechanisms in atmospheric pressure photoionization of biomolecules

TuOr03

10:40 – 11:00

G. Zurek, B. Schneider, A. Ingendoh, C. Baessmann, M. Spraul, C. Fusch (presented by Marcus Macht, Bruker Daltonics)

Metabolic profiling of baby urine by LC/MS/MS and chemometry

 

11:00 – 11:30

Coffee break

 

Chairman: E.R. Williams

TuPl03

11:30 – 12:00

P. Derrick

Ion optics at elevated pressures: electrospray and electrodynamics

TuOr04

12:00 – 12:20

P. Řihák, J. Čáslavský

Identification of cluster boron compounds by ESI-MS

TuOr05

12:20 – 12:40

R. Frański, B. Gierczyk, G. Schroeder, S. Pieper, A. Springer, M. Linscheid

Electrospray ionization mass spectrometric study of mercury complexes of n-heterocyclic carbenes derived from 1,2,4-triazolium salt precursors

TuOr06

12:40 – 13:00

G. Moneti, S. Francese, G. Mastrobuoni, G. Pieraccini, R. Seraglia, G. Valitutti and P. Traldi

Do collisions inside the collision cell play a relevant role in CID-LIFT experiments?

 

13:00 – 14:00

Lunch

 

14:00 – 15:30

Poster session 2

 

Chairperson: M. Claeys

TuPl04

15:30 – 16:00

F.-X. Li, P. B. Armentrout

The chemistry of third-row transition metal ions

TuOr07

16:00 – 16:20

H. Wincel

Hydration of gas-phase protonated and sodiated amino acids

TuOr08

16:20 – 16:40

O. Martiskainen, B. Ośmiałowski, R. Gawinecki, K. Pihlaja

Electron ionization mass spectra and tautomerism of 2-phenacylpyridines

TuOr09

16:40 – 17:00

J. Loth (Anchem – representative of Thermo Corporation)

 

17:00 – 17:30

Coffee break

 

Chairman: P. Derrick

TuPl05

17:30 – 18:00

H.K. Ervasti, K.J. Jobst, P.C. Burgers, P.J.A. Ruttink, J.K. Terlouw

The dissociation chemistry of the acrylonitrile dimer ion: an experimental and theoretical study

TuPl06

18:00 – 18:30

D. Kuck

A review on a renaissance: gaseous C7H9+ and related “simple” alkylbenzenium ions

TuOr10

18:30 – 18:50

K.J. Jobst, P.C. Burgers, P.J.A. Ruttink, J.K. Terlouw

The loss of NH2O from the N-hydroxyacetamide radical cation CH3C(=O)NHOH•+ : an ion-catalysed rearrangement

 

19:30 –

Grill party

Wednesday, May 17th, 2006

 

Chairman: J.K. Terlouw

WePl01

9:00 – 9:30

M. Claeys, W. Wang, I. Kourtchev, R. Szmigielski, R. Vermeylen, and W. Maenhaut

Characterisation of secondary organic aerosol from photo-oxidation of isoprene: a review of field and chamber studies

WePl02

9:30 – 10:00

K. Połeć-Pawlak, J.K. Abramski, R. Ruzik, O. Semenova, C.G. Hartinger, A.R. Timerbaev, B.K. Keppler, M. Jarosz

Interaction of selected noble metal complexes with albumin and transferrin – a study by CE-ICP-MS

WeOr01

10:00 – 10:20

R. Szmigielski, R. Vermeylen, K. Szmigielska, J. D. Surratt, J. H. Kroll, N.L. Ng, S.M. Murphy, L. Hildebrandt, J.H. Seinfeld, M. Claeys

Use of complementary MS approaches to the characterization of secondary organic aerosol from photooxidation of isoprene

WeOr02

10:20 – 10:40

L. Montanari, C. Flego, A. Rizzi, A. Smaniotto, R. Seraglia, P. Traldi

Factors influencing the resolution drop in LDI analysis of complex natural matrix

 

10:40 – 11:20

Coffee break

 

Chairman: P. Traldi

WePl03

11:20 – 11:50

K. Lemr, V. Ranc, P. Fryčák, P. Bednář, V. Havlíček

Isomeric discrimination by mass spectrometry using the kinetic method

WeOr03

11:50 – 12:10

M.V. Kosevich, O.A. Boryak, V.V. Chagovets, V.V. Shelkovsky, V.A. Pashynska, and A. Gomory

Matrix suppression effect under FAB/SIMS revised

WeOr04

12:10 – 12:30

S. Cristoni

Surface activated chemical ionization and high flow gradient chromatography to reduce matrix effect

WeOr05

12:30 – 12:50

T. Bieńkowski (Applera)

 

13:00 – 14:00

Lunch

 

14:15 – 17:00

Short walk in the surrounding hills (depending on the weather conditions)

     

 

Chairman: K. Lemr

WePl04

17:00 – 17:30

P. Traldi

The evolution of quadrupole ion trap mass spectrometry

WePl05

17:30 – 18:00

L. Drahos, K. Vékey

Peptide fragmentation – modelling and experiment design

WeOr06

18:00 – 18:20

R. Flamini, A. Dalla Vedova, D. Cancian, A. Panighel, M. De Rosso

GC/PICI-MS and MS/MS characterization of volatile aromatic compounds from five different woods used in making of barrels for the wine aging

WeOr07

18:20 – 18:40

M. Zimnicka, W. Danikiewicz

Generation and reactions of anionic s-adducts of nitrothiophenes and nitrofurans with C-H acids in a gas phase

 

18:40 – 19:00

Concluding remarks and invitation to the 25th IMMS

 

20:00 –

Leaving party

Thursday, May 18th, 2006

Departure of participants

 

Post-conference tour to Szczyrk and Pszczyna has been cancelled due to insufficient number of participants

Posters - Monday Session

MoPo01

Robert Jirásko, Michal Holčapek, Lenka Kolářová

ESI-MSn characterization of organometallic Sb(III), Bi(III) and Sn(IV) compounds

MoPo02

Henri K. Ervasti, Karl J. Jobst, Peter C. Burgers, Paul J.A. Ruttink, Johan K. Terlouw

Can the prebiotic pyrimidine molecule be formed via an ion-molecule reaction of acrylonitrile and HCN ? Theoretical description of a roller coaster reaction

MoPo03

S. Bekesova; M. Polakova; M. Mastihubova; V. Kovacik

ESI-Q-TOF MS study of 4-hydroxyphenylalkyl glycosides

MoPo04

J. Čáslavský and P. Řihák

Mass spectrometry of cluster boron compounds

MoPo05

P.Kosubová, R. Kalusová

Determination of pesticide residues in feedingstuffs using a HPLC-MS technique

MoPo06

V.V. Chagovets, O.A. Boryak, V.V. Shelkovsky, S.G. Stepanian and M.V. Kosevich 

Secondary emission mass spectrometric and theoretical study of nitrogen bases interactions with Cl- anion

MoPo07

Ildikó Szabó, Gitta Schlosser, Ferenc Hudecz, Gábor Mező

Demonstration of a non-native disulfide pattern in alpha-conotoxin-GI peptide by enzymatic digestion and tandem mass spectrometry

MoPo08

M. Juhász, Z. Zalán, F. Fülöp and K. Pihlaja

Mass spectrometric behaviour of 1,3,4,2-oxadiazaphosphinane 2-oxides under electron ionization

MoPo09

V. Kováčik, S. Bekešová, V. Pätoprstý, P.Řehulka, J.Chmelík, P.Kováč

Positive MALDI TOF/TOF mass spectrometric fragmentation of synthetic analogs of saccharide part of lipopolysaccharides of  vibrio cholerae O:1

MoPo10

Jan Nedved, Martin Zabka, Vladimir Havlicek, Jan Sklenar, Jana Olsovska

The mass spectrometry analysis of secondary metabolites of pseudallescheria boydii

MoPo11

I. Fenesan, Simona Nicoara, Monica Culea, A. Hantz, Al. Alexandri

EI/MS analysis of some new cyanacetamid- and cyanethyl- acetate oximinic esters of amidothiophosphonic acids

MoPo12

Simona Nicoara, N. Palibroda, I. Fenesan

Cleavage pathways of some p-aminobenzene thiophosphororganic sulfonamides under electron impact ionisation

MoPo13

M. Puchalska, J. Witowska-Jarosz, E. Rosłoniec, E. Orlińska-Mianowska, K. Połeć-Pawlak, M. Jarosz

Mass spectrometry in analysis of fabrics of historical value: identification of blue natural and synthetic dyestuffs

MoPo14

Pavel Řehulka, Helena Řehulková, Janette Bobáľová, Jitka Žídková and Josef Chmelík

High sequence coverage of the nonspecific lipid transfer protein 1 from barley

MoPo15

A. Panighel, A. Dalla Vedova, M. Salvadori and R. Flamini

GC/MS study of free and glycoside terpene alcohols of White Muscat grape marc used in the Italian Grappa production

MoPo16

G. Aldini, L. Gamberoni, M. Orioli,  L. Regazzoni,  R. Maffei Facino, M. Carini

ESI-MS infusion in the development of carbonyl quenchers: a rapid and versatile tool to study reactivity, specificity, and reaction mechanisms

MoPo17

Monica Culea, Onuc Cozar and Dumitru Ristoiu

Methods validation for THMs determination in drinking water

MoPo18

Olli Martiskainen, Márta Juhász, Zita Zalán, Ferenc Fülöp, and Kalevi Pihlaja

Electron ionization mass spectra of phosphorus-containing heterocycles. 1,2,3,4,4a,5,6,7,8,8a-decahydro-1,3,2-benzodiazaphosphinine 2-oxides

MoPo19

Maria Walczak, Joanna Szymura-Oleksiak, Marek Bednarski, Grażyna Groszek, Małgorzata Szafarz, Barbara Filipek

Use of liquid chromatography – tandem mass spectrometry method for the analysis of non-selective b-adrenolytic compound (2f109) in rat plasma

MoPo20

Dariusz Błachut, Witold Danikiewicz, Marian Olejnik, Krystyna Wojtasiewicz and Zbigniew Czarnocki

The MS study of some derivatives related to amphetamine chemistry

MoPo21

G. Adamus, M. Kowalczuk

Structural studies of copolyesters topology by ESI-MS technique

MoPo22

A. Mari, V. Carbone, P. Saggese, A. Malorni

Polyphenolic profile of a typical southern italy apple cultivar by HPLC tandem mass spectrometry and ultra performance liquid chromatography

MoPo23

Barbora Papouskova, Petr Bednar, Ouarda Brahmia, Hana Mestankova, Jaromir Jirkovsky, Karel Lemr

Mass spectrometric study of chemical warfare agents degradation

MoPo24

Petr Barták, Petr Bednář, Stanislav Opluštil, Lukáš Müller, Magdalena Megová, Karel Lemr, Lubomír Čáp, Jakub Rolčík, Martin Rulík

GC/MS determination of phospholipid fatty acids – possibilities and limitations

MoPo25

P. Bednář, B. Papoušková, M. Koutník, D. Jirovský, A. Balcárková, L. Müller, P. Barták, J. Stávek, J. Balík, K. Lemr

Mass spectrometric analysis of anthocyanins – new aspects and applications

MoPo26

M. Cuccurullo, G. Cacace, A. Vilasi, G. Pocsfalvi, A. Malorni, G.B. Capasso

Comparative analysis of protein patterns of urine and dialyzed peritoneal liquid of a patient with kidney failure

MoPo27

Petru Berdea, Stela Cuna, Cornel Cuna and Gabriela Balas

On the correction of the memory effect in isotopic analysis

MoPo28

C.Cuna, V. Bocos-Bintintan, Stela Cuna

Ultrasensitive detection of the pollutants by ion mobility spectrometry- mass spectrometry

MoPo29

F. Basilico, L. Benazzi, D. Di Silvestre, A. Petretto, I. Levreri, G. Melioli C. Farina, F. Mori and P. Mauri

New approach method for rapid identification of Hemoglobin variant using LC-MS/MS combined with peptide database

MoPo30

Miroslav Lísa, Michal Holčapek, Prokop Bernášek and Helena Sovová

HPLC/MS characterization of products of black currant oil enzymatic hydrolysis

MoPo31

J. Sikora, T. Rubel, J. Poznański, M. Boguta, M. Dadlez

Mass spectrometry based differential proteomics of the mitochondria of [psi+] and [psi-] Saccharomyces Cerevisiae strains

MoPo32

 

A. Pamula, C. Cuna, M. Leuca and I. Dobocan

Double beam, double quadrupole mass filter for precise isotope ratio measurements

Posters - Tuesday Session

 TuPo01

I.B. Szymańska and A.Błajet

Electron-impact ionization mass spectra of copper and palladium complexes with perfluorinated carboxylates and alkenes

 TuPo02

Katalin B. Bai, Gitta Schlosser, Ferenc Hudecz, Gabor Mező

Unusual enzymatic degradation of branched polypeptide-methotrexate conjugates studied by high-performance liquid chromatography and tandem mass spectrometry

 TuPo03

I. Rutkowska-Włodarczyk, A. Kupniewska-Kozak,  A. Dziembowski, B. Seraphin and M. Dadlez

Protein’s structures determinations using mass spectrometry

 TuPo04

P. Kačer, K. Syslová, M. Kuzma, P. Klusáčková, J. Lebedová, D. Pelclová

HPLC/MS analysis of oxidative stress biomarkers

 TuPo05

R. Lizak, J. Rachubik, J. Piskorska-Pliszczynska and B. Kowalski

Analytical requirements for dioxin determination in dairy products by high resolution mass spectrometry

 TuPo06

R. Lizak, J. Piskorska-Pliszczynska, J. Rachubik, M. Warenik and B. Kowalski

HrGC-HRMS as a confirmatory method for PCDD/Fs analysis in selected feedingstuffs

 TuPo07

Karel Mazanec, Karel Šlais, and Josef Chmelík

Characterization of color low-molecular mass pI markers by MALDI-TOF/TOF MS and their use for direct determination of pI value of proteins

 TuPo08

L. Mazurowska and M. Mojski

ESI - MS study of tripeptide copper complexes transport through a model membrane of stratum corneum

 TuPo09

M. Culea

Characterization of some bioactive compounds in herbs and drinks

 TuPo10

V.A. Pashynska, M.V. Kosevich, H. Van den Heuvel, M. Claeys

Comparative analysis of in-source CID and MS/MS CID under ESI mass spectrometry by the example of bisquaternary ammonium agent decamethoxinum

 TuPo11

Marco Pitton, Federico M Rubino, Gabri Brambilla and Antonio Colombi

Energy-resolved mass spectrometric study of the glutathione metaboloma peptides.

 TuPo12

Ferenc Pollreisz, Tímea Imre, Gitta Schlosser, Pál Szabó, Gabriella Pocsfalvi, Károly Vékey

Fragmentation behavior of intact proteins on a Q-TOF type instrument

 TuPo13

R. Ruzik, K. Abramski, E. Lipiec, M. Ciurzyńska, H. Gawrońska and K. Połeć-Pawlak

The role of phytochelatins in deactivation of cadmium and lead in arabidopsis thaliana – the task for electrospray MS

 TuPo14

L. Mattoli, F. Cangi, A. Maidecchi, C. Ghiara, E. Ragazzi, M. Tubaro, L. Stella, F. Tisato and P. Traldi

Metabolomic fingerprinting of plant extracts

 TuPo15

Maria Walczak, Ewelina Jezierska, Joanna Szymura-Oleksiak, Elżbieta Pękala

Pharmacokinetics  and tissue distribution of propentofylline and its chiral metabolite in rats

 TuPo16

K. Syslová, P. Kačer, M. Kuzma, P. Klusáčková, J. Lebedová, D. Pelclová

Coupling HPLC/MS with immunoseparation for monitoring of inflammatory markers in exhaled breath condensate

 TuPo17

L. R. Orelli, M. B. García, I. A. Perillo, L. Tonidandel and P. Traldi

A comparison of electron ionization and electrospray behaviours of some N,N´- disubstituted hexahydropyrimidines

 TuPo18

Janina Witowska-Jarosz and Piotr Suchocki

Studies of selenium containing acyl glycerides by mass spectrometry

 TuPo19

Arletta Pokrop and Janusz Jurczak

Studies of formation and decomposition of anion complexes with macrocyclic tetraamides using electrospray ionization mass spectrometry

 TuPo20

N. Kirschner, L. I. Gémesi and M. Kapás

Mass spectral properties of RGH-10885 and its metabolites in ion trap LC/MS and LC/MS/MS

 TuPo21

Federico M Rubino Marco Pitton, Gabri Brambilla and Antonio Colombi

Mechanistic insight into the toxicity of heavy metals (Zn, Cd, Hg, Pb) through the mass spectrometric study of their glutathione conjugates.

 TuPo22

Gitta Schlosser, Gabriella Pocsfalvi, Zsuzsa Majer

Al(III) binding of neurofilament analogue peptides studied by electrospray ionization tandem mass spectrometry

 TuPo23

Zabka M., Nedved J., Olsovska J., Sklenar J. and Havlicek V.

Effect of cultivation conditions on production of secondary metabolites of Pseudallescheria boydii.

 TuPo24

Vaclav Ranc, Petr Bednar, Petr Frycak and Karel Lemr

Discrimination of isomers by the Cooks kinetic method – comparison of instruments

 TuPo25

Małgorzata Olejnik, Teresa Szprengier-Juszkiewicz

coccidiostats residues analysis: problems with quantification by LCQDuo ion trap spectrometer

 TuPo26

Jan Sklenar, Miroslav Sulc, Martin Zabka, and Vladimir Havlicek

The fungus Pseudallescheria boydii secreted cyclic peptide - the potential marker in diagnostics of fungal infection?

 TuPo27

Łukasz Marczak, Maciej Stobiecki

Identification of proteins from white lupin (Lupinus albus) apoplastic fluids using MALDI-TOF mass spectrometer

 TuPo28

Lewis P. Mark, Matthew C. Gill, Marek Mahut and Peter J. Derrick

A dual-channeled nano-electrospray source for mass spectrometry

 TuPo29

Matthew C. Gill, Mark P. Barrow, Alexander W. Colburn, Anastassios E. Giannakopulos and Peter J. Derrick

The ion conveyor: an intermediate pressure ion focussing and transfer device

 TuPo30

L. Sanguinet, O. Alévêque, P. Blanchard, M. Dias, E. Levillain, D. Rondeau

Desorption/ionization on self-assembled monolayer surface (DIAMS): a novel free laser ionization/desorption method

 TuPo31

Joanna Biernat, Krystyna Szymczyk

Determination of different derivatives of 3- monochloropropane-1,2-diol (3-MCPD) in sugar by GC/MS/MS