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2-{[2-(Ethylthio)phenyl]thio}acetic acid
SpectraBase Compound ID 9o2SHJmM4OS
InChI InChI=1S/C10H12O2S2/c1-2-13-8-5-3-4-6-9(8)14-7-10(11)12/h3-6H,2,7H2,1H3,(H,11,12)
InChIKey NYRQQONCMBVUEU-UHFFFAOYSA-N
Mol Weight 228.32 g/mol
Molecular Formula C10H12O2S2
Exact Mass 228.027872 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7HpDmVeA32X
Name 2-{[2-(Ethylthio)phenyl]thio}acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H12O2S2
InChI InChI=1S/C10H12O2S2/c1-2-13-8-5-3-4-6-9(8)14-7-10(11)12/h3-6H,2,7H2,1H3,(H,11,12)
InChIKey NYRQQONCMBVUEU-UHFFFAOYSA-N
Molecular Weight 228.324 g/mol
SMILES OC(CSc1c(SCC)cccc1)=O
SPLASH splash10-0ufr-3910000000-e764ab050e3b2c5639eb
Source of Spectrum F-55-14075-12
Synonyms {[2-(ethylsulfanyl)phenyl]sulfanyl}acetic acid
Wiley ID 840077