2-(benzo[d][1,3]dioxol-5-yl)-2-(phenylthio)acetic acid

SpectraBase Compound ID	2LM0jOAwrXl
InChI	InChI=1S/C15H12O4S/c16-15(17)14(20-11-4-2-1-3-5-11)10-6-7-12-13(8-10)19-9-18-12/h1-8,14H,9H2,(H,16,17)
InChIKey	KTXGGUYJPLAAGJ-UHFFFAOYSA-N Google Search
Mol Weight	288.32 g/mol
Molecular Formula	C15H12O4S
Exact Mass	288.04563 g/mol

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SpectraBase Spectrum ID	7Zd3dyfqDGg
Name	2-(benzo[d][1,3]dioxol-5-yl)-2-(phenylthio)acetic acid
Alternate Name(s)	2-(1,3-benzodioxol-5-yl)-2-phenylsulfanylacetic acid 2-(1,3-benzodioxol-5-yl)-2-phenylsulfanyl-acetic acid 2-(1,3-benzodioxol-5-yl)-2-phenylsulfanyl-ethanoic acid
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C15H12O4S
InChI	InChI=1S/C15H12O4S/c16-15(17)14(20-11-4-2-1-3-5-11)10-6-7-12-13(8-10)19-9-18-12/h1-8,14H,9H2,(H,16,17)
InChIKey	KTXGGUYJPLAAGJ-UHFFFAOYSA-N
Literature Reference DOI	10.1021/ol071344y
Molecular Weight	288.317 g/mol
SMILES	OC(C(c1ccc2c(c1)OCO2)Sc1ccccc1)=O
SPLASH	splash10-00or-4920000000-a9f54a2f5c2e5ed349f7
Source of Spectrum	A1-9-3503/SMS19-17
Wiley ID	1758436