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PHENYLTHIOMETHYLBUTANOATE
SpectraBase Compound ID 70swetWnChN
InChI InChI=1S/C11H14O2S/c1-2-6-11(12)13-9-14-10-7-4-3-5-8-10/h3-5,7-8H,2,6,9H2,1H3
InChIKey UTSQFNFYCDUPHV-UHFFFAOYSA-N
Mol Weight 210.29 g/mol
Molecular Formula C11H14O2S
Exact Mass 210.071451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FmmeUEZ7NTp
Name Butanoic acid, (phenylthio)methyl ester
CAS Registry Number 104803-83-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H14O2S
InChI InChI=1S/C11H14O2S/c1-2-6-11(12)13-9-14-10-7-4-3-5-8-10/h3-5,7-8H,2,6,9H2,1H3
InChIKey UTSQFNFYCDUPHV-UHFFFAOYSA-N
Molecular Weight 210.291 g/mol
SMILES C(OCSc1ccccc1)(=O)CCC
SPLASH splash10-022i-9510000000-48a67f62365bbd61e197
Source of Spectrum B-39-86-4
Synonyms (phenylsulfanyl)methyl butyrate Phenylthiomethyl butanoate Butanoic acid (phenylthio)methyl ester Phenylsulfanylmethyl butanoate
Wiley ID 1208821