Detalhe da pesquisa
1.
Structural Elucidation of Agrochemical Metabolic Transformation Products Based on Infrared Ion Spectroscopy to Improve In Silico Toxicity Assessment.
Chem Res Toxicol
; 37(1): 81-97, 2024 01 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-38118149
2.
Exploring the scaling factors for infrared modes of PANHs - A case study on cationic 3-Azafluoranthene.+ and protonated 3-Azafluoranthene.
Chemphyschem
; : e202300915, 2024 May 17.
Artigo
em Inglês
| MEDLINE | ID: mdl-38758018
3.
Anomeric Triflates versus Dioxanium Ions: Different Product-Forming Intermediates from 3-Acyl Benzylidene Mannosyl and Glucosyl Donors.
J Org Chem
; 89(3): 1618-1625, 2024 Feb 02.
Artigo
em Inglês
| MEDLINE | ID: mdl-38235652
4.
Hydrogen Bonding Shuts Down Tunneling in Hydroxycarbenes: A Gas-Phase Study by Tandem-Mass Spectrometry, Infrared Ion Spectroscopy, and Theory.
J Am Chem Soc
; 145(22): 12124-12135, 2023 Jun 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-37235775
5.
Targeted Small-Molecule Identification Using Heartcutting Liquid Chromatography-Infrared Ion Spectroscopy.
Anal Chem
; 95(6): 3406-3413, 2023 02 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-36735826
6.
An In Silico Infrared Spectral Library of Molecular Ions for Metabolite Identification.
Anal Chem
; 95(23): 8998-9005, 2023 06 13.
Artigo
em Inglês
| MEDLINE | ID: mdl-37262385
7.
Distinguishing Oligosaccharide Isomers Using Far-Infrared Ion Spectroscopy: Identification of Biomarkers for Inborn Errors of Metabolism.
Anal Chem
; 95(26): 9787-9796, 2023 07 04.
Artigo
em Inglês
| MEDLINE | ID: mdl-37341384
8.
Characterization of Elusive Reaction Intermediates Using Infrared Ion Spectroscopy: Application to the Experimental Characterization of Glycosyl Cations.
Acc Chem Res
; 55(12): 1669-1679, 2022 06 21.
Artigo
em Inglês
| MEDLINE | ID: mdl-35616920
9.
Novel cerebrospinal fluid biomarkers of glucose transporter type 1 deficiency syndrome: Implications beyond the brain's energy deficit.
J Inherit Metab Dis
; 46(1): 66-75, 2023 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-36088537
10.
Succinic semialdehyde dehydrogenase deficiency in mice and in humans: An untargeted metabolomics perspective.
J Inherit Metab Dis
; 2023 Jul 16.
Artigo
em Inglês
| MEDLINE | ID: mdl-37455357
11.
Unusual Actinyl Complexes with a Redox-Active N,S-Donor Ligand.
Inorg Chem
; 62(28): 11016-11027, 2023 Jul 17.
Artigo
em Inglês
| MEDLINE | ID: mdl-37390399
12.
Correlated proton dynamics in hydrogen bonding networks: the benchmark case of 3-hydroxyglutaric acid.
Phys Chem Chem Phys
; 26(1): 198-208, 2023 Dec 21.
Artigo
em Inglês
| MEDLINE | ID: mdl-38053486
13.
Spectroscopic Investigation of the Metal Coordination of the Aromatic Amino Acids with Zinc and Cadmium.
J Phys Chem A
; 127(16): 3560-3569, 2023 Apr 27.
Artigo
em Inglês
| MEDLINE | ID: mdl-37053556
14.
Characterization of Cyclic N-Acyliminium Ions by Infrared Ion Spectroscopy.
Chemistry
; 28(9): e202104078, 2022 Feb 16.
Artigo
em Inglês
| MEDLINE | ID: mdl-34911145
15.
Competing C-4 and C-5-Acyl Stabilization of Uronic Acid Glycosyl Cations.
Chemistry
; 28(63): e202201724, 2022 Nov 11.
Artigo
em Inglês
| MEDLINE | ID: mdl-35959853
16.
Stabilization of Glucosyl Dioxolenium Ions by "Dual Participation" of the 2,2-Dimethyl-2-(ortho-nitrophenyl)acetyl (DMNPA) Protection Group for 1,2-cis-Glucosylation.
J Org Chem
; 87(14): 9139-9147, 2022 07 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-35748115
17.
Structural Elucidation of Agrochemicals and Related Derivatives Using Infrared Ion Spectroscopy.
Environ Sci Technol
; 56(22): 15563-15572, 2022 11 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-36214158
18.
Laboratory IR Spectra of the Ionic Oxidized Fullerenes C60O+ and C60OH.
J Phys Chem A
; 126(19): 2928-2935, 2022 May 19.
Artigo
em Inglês
| MEDLINE | ID: mdl-35533303
19.
Isomer-Specific Two-Color Double-Resonance IR2MS3 Ion Spectroscopy Using a Single Laser: Application in the Identification of Novel Psychoactive Substances.
Anal Chem
; 93(4): 2687-2693, 2021 02 02.
Artigo
em Inglês
| MEDLINE | ID: mdl-33470107
20.
Metabolite Identification Using Infrared Ion SpectroscopyâNovel Biomarkers for Pyridoxine-Dependent Epilepsy.
Anal Chem
; 93(46): 15340-15348, 2021 11 23.
Artigo
em Inglês
| MEDLINE | ID: mdl-34756024