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(1-Methyl-1H-indol-3-ylsulfanyl)-acetic acid
SpectraBase Compound ID CL5IGjidaHg
InChI InChI=1S/C11H11NO2S/c1-12-6-10(15-7-11(13)14)8-4-2-3-5-9(8)12/h2-6H,7H2,1H3,(H,13,14)
InChIKey DVPGVQNKZXBQPX-UHFFFAOYSA-N
Mol Weight 221.27 g/mol
Molecular Formula C11H11NO2S
Exact Mass 221.05105 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Juk9Vwz4JCb
Name (1-Methyl-1H-indol-3-ylsulfanyl)-acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11NO2S
InChI InChI=1S/C11H11NO2S/c1-12-6-10(15-7-11(13)14)8-4-2-3-5-9(8)12/h2-6H,7H2,1H3,(H,13,14)
InChIKey DVPGVQNKZXBQPX-UHFFFAOYSA-N
Molecular Weight 221.274 g/mol
SMILES OC(CSc1c[n](c2c1cccc2)C)=O
SPLASH splash10-03di-3910000000-ab662d947fb2bbee4df9
Synonyms 2-(1-Methylindol-3-yl)sulfanylacetic acid 2-(1-Methylindol-3-yl)sulfanylethanoic acid 2-[(1-methyl-3-indolyl)thio]acetic acid 2-[(1-methylindol-3-yl)thio]acetic acid
Wiley ID 1465207