5-tert-butyl-3-[(phenylthio)methyl]-2-thiophenecarboxylic acid, methyl ester

SpectraBase Compound ID	1kVD9I03vFA
InChI	InChI=1S/C17H20O2S2/c1-17(2,3)14-10-12(15(21-14)16(18)19-4)11-20-13-8-6-5-7-9-13/h5-10H,11H2,1-4H3
InChIKey	LHGQBXCWCGFSJD-UHFFFAOYSA-N Google Search
Mol Weight	320.47 g/mol
Molecular Formula	C17H20O2S2
Exact Mass	320.090472 g/mol

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SpectraBase Spectrum ID	7ecoySAcWEE
Name	5-tert-BUTYL-3-[(PHENYLTHIO)METHYL]-2-THIOPHENECARBOXYLIC ACID, METHYL ESTER
Source of Sample	MAYBRIDGE CHEMICAL COMPANY LTD., NORTH CORNWALL, ENGLAND
Catalog Number	SEW 509
Copyright	Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H20O2S2
InChI	InChI=1S/C17H20O2S2/c1-17(2,3)14-10-12(15(21-14)16(18)19-4)11-20-13-8-6-5-7-9-13/h5-10H,11H2,1-4H3
InChIKey	LHGQBXCWCGFSJD-UHFFFAOYSA-N
Melting Point	48-50C
Molecular Weight	320.464996
Synonyms	2-THIOPHENECARBOXYLIC ACID, 5-TERT-BUTYL-3-//PHENYLTHIO/METHYL/-, METHYL ESTER
Technique	FILM (CAST FROM CHCl3)