2-Ethylsulfanylethyl 6-methyl-2-oxidanylidene-4-[4-(trifluoromethyloxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylate

SpectraBase Compound ID	Jqexg8XTWft
InChI	InChI=1S/C17H19F3N2O4S/c1-3-27-9-8-25-15(23)13-10(2)21-16(24)22-14(13)11-4-6-12(7-5-11)26-17(18,19)20/h4-7,14H,3,8-9H2,1-2H3,(H2,21,22,24)
InChIKey	NXGUFZBGEYIBFQ-UHFFFAOYSA-N Google Search
Mol Weight	404.4 g/mol
Molecular Formula	C17H19F3N2O4S
Exact Mass	404.101763 g/mol

View the Full Spectrum for FREE!

SpectraBase Spectrum ID	9vB2N09P7BO
Name	5-pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-6-methyl-2-oxo-4-[4-(trifluoromethoxy)phenyl]-, 2-(ethylthio)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	404.101762759 u
Formula	C17H19F3N2O4S
InChI	InChI=1S/C17H19F3N2O4S/c1-3-27-9-8-25-15(23)13-10(2)21-16(24)22-14(13)11-4-6-12(7-5-11)26-17(18,19)20/h4-7,14H,3,8-9H2,1-2H3,(H2,21,22,24)
InChIKey	NXGUFZBGEYIBFQ-UHFFFAOYSA-N
Molecular Weight	404.404 g/mol
NMR Offset	18.0068
NMR Spectrometer Frequency	500.134
Observed nucleus	1H
Sample State	Soluted
Sample_ID	1H_CB_2017_13023
Solvent	DMSO-d6
Source	Vendor ID: NMR/10301008; Lab Info: SAS; Lab Number: SAS-0004254