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thioacetic acid, S-phenyl ester

View entire compound with spectra: 8 NMR, 5 FTIR, 1 Raman, 1 UV-Vis, and 8 MS (GC)

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 B0kvmdbUdCx
Name Ethanethioic acid, S-phenyl ester
Alternate Name(s) 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
CAS Registry Number 934-87-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
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 c1cc(ccc1)SC(=O)C
SPLASH splash10-03di-1900000000-3a5ccad66b993ef23408
Source of Spectrum Y-19-651-0
Wiley ID 1148659