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(1H-indol-3-ylsulfanyl)acetic acid
SpectraBase Compound ID JONfi7xttrh
InChI InChI=1S/C10H9NO2S/c12-10(13)6-14-9-5-11-8-4-2-1-3-7(8)9/h1-5,11H,6H2,(H,12,13)
InChIKey MVTHCDJJTYSGFW-UHFFFAOYSA-N
Mol Weight 207.25 g/mol
Molecular Formula C10H9NO2S
Exact Mass 207.0354 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1YE9SoLt4H9
Name (1H-Indol-3-ylsulfanyl)acetic acid
CAS Registry Number 54466-88-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H9NO2S
InChI InChI=1S/C10H9NO2S/c12-10(13)6-14-9-5-11-8-4-2-1-3-7(8)9/h1-5,11H,6H2,(H,12,13)
InChIKey MVTHCDJJTYSGFW-UHFFFAOYSA-N
Molecular Weight 207.247 g/mol
SMILES [nH]1c2c(c(SCC(=O)O)c1)cccc2
SPLASH splash10-0002-3930000000-7a9690a12901612a25e2
Source of Spectrum AD-0-2532-0
Synonyms 2-(1H-indol-3-ylsulfanyl)acetic acid 2-(1H-indol-3-ylsulfanyl)ethanoic acid 2-(1H-indol-3-ylthio)acetic acid Acetic acid, 2-(3-indolylthio)-
Wiley ID 1434680