Ethyl 4-amino-2-thioxo-3-[3-(trifluoromethyl)phenyl]-2,3-dihydro-1,3-thiazole-5-carboxylate

SpectraBase Compound ID	LiLIK5OcFx2
InChI	InChI=1S/C13H11F3N2O2S2/c1-2-20-11(19)9-10(17)18(12(21)22-9)8-5-3-4-7(6-8)13(14,15)16/h3-6H,2,17H2,1H3
InChIKey	WQJIGGXTVAAIHW-UHFFFAOYSA-N Google Search
Mol Weight	348.36 g/mol
Molecular Formula	C13H11F3N2O2S2
Exact Mass	348.021404 g/mol

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SpectraBase Spectrum ID	IQLuiQIgzaV
Name	5-thiazolecarboxylic acid, 4-amino-2,3-dihydro-2-thioxo-3-[3-(trifluoromethyl)phenyl]-, ethyl ester
Copyright	Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	348.021404437 u
Formula	C13H11F3N2O2S2
InChI	InChI=1S/C13H11F3N2O2S2/c1-2-20-11(19)9-10(17)18(12(21)22-9)8-5-3-4-7(6-8)13(14,15)16/h3-6H,2,17H2,1H3
InChIKey	WQJIGGXTVAAIHW-UHFFFAOYSA-N
Molecular Weight	348.358 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_10051
Solvent	DMSO-d6
Source	Vendor ID: NMR/10231219; Lab Info: GSB; Lab Number: GSB-0000005