3-Thiophenecarboxylic acid, 2-benzoyltetrahydro-2-[(phenylmethyl)thio]-, methyl ester

SpectraBase Compound ID	4iniTEJNHee
InChI	InChI=1S/C20H20O3S2/c1-23-19(22)17-12-13-24-20(17,18(21)16-10-6-3-7-11-16)25-14-15-8-4-2-5-9-15/h2-11,17H,12-14H2,1H3
InChIKey	FGCWUHHNFVOTQZ-UHFFFAOYSA-N Google Search
Mol Weight	372.5 g/mol
Molecular Formula	C20H20O3S2
Exact Mass	372.085387 g/mol

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SpectraBase Spectrum ID	4RxEVV2Efu8
Name	3-Thiophenecarboxylic acid, 2-benzoyltetrahydro-2-[(phenylmethyl)thio]-, methyl ester
Alternate Name(s)	2-Benzylthio-2-benzoyl-3-methoxycarbonyltetrahydrothiophene benzyl 3,4-dideoxy-3-(methoxycarbonyl)-1-phenyl-2,5-dithiopentos-2-ulofuranoside
CAS Registry Number	129206-10-6
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C20H20O3S2
InChI	InChI=1S/C20H20O3S2/c1-23-19(22)17-12-13-24-20(17,18(21)16-10-6-3-7-11-16)25-14-15-8-4-2-5-9-15/h2-11,17H,12-14H2,1H3
InChIKey	FGCWUHHNFVOTQZ-UHFFFAOYSA-N
Molecular Weight	372.497 g/mol
SMILES	C1(C(C(=O)OC)CCS1)(C(=O)c1ccccc1)SCc1ccccc1
SPLASH	splash10-0aor-0980000000-8026dd07a3bf3e06622e
Source of Spectrum	F-46-1787-7
Wiley ID	1355379