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thioacetic acid, S-phenyl ester
SpectraBase Compound ID 2MNh4KaWJj5
InChI InChI=1S/C8H8OS/c1-7(9)10-8-5-3-2-4-6-8/h2-6H,1H3
InChIKey WBISVCLTLBMTDS-UHFFFAOYSA-N
Mol Weight 152.21 g/mol
Molecular Formula C8H8OS
Exact Mass 152.029586 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2iksPQJ4Tvj
Name Ethanethioic acid, S-phenyl ester
CAS Registry Number 934-87-2
Comments Less than 3 mono-isotopic peaks
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Formula C8H8OS
InChI InChI=1S/C8H8OS/c1-7(9)10-8-5-3-2-4-6-8/h2-6H,1H3
InChIKey WBISVCLTLBMTDS-UHFFFAOYSA-N
Molecular Weight 152.211 g/mol
SMILES C(Sc1ccccc1)(=O)C
SPLASH splash10-03di-0900000000-0acfbd3fca84057d2cc7
Source of Spectrum SK-29-355-0
Synonyms ethanethioic acid S-phenyl ester S-Phenyl ethanethioate Phenyl thioacetate Acetic acid, thio-, S-phenyl ester S-Phenyl thioacetate Phenyl thiolacetate Thioacetic acid S-phenyl ester Thiophenyl acetate AI3-15532 BRN 1858641 EINECS 213-294-2
Wiley ID 880347