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(1S)-1-phenylethanethiol
SpectraBase Compound ID 82xa4D9OyvZ
InChI InChI=1S/C8H10S/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H3/t7-/m0/s1
InChIKey QZZBJCFNHPYNKO-ZETCQYMHSA-N
Mol Weight 138.23 g/mol
Molecular Formula C8H10S
Exact Mass 138.050321 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID VMUDf5cf25
Name (1S)-1-phenylethanethiol
Alternate Name(s) Benzenemethanethiol, .alpha.-methyl-, (S)-
CAS Registry Number 33877-11-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H10S
InChI InChI=1S/C8H10S/c1-7(9)8-5-3-2-4-6-8/h2-7,9H,1H3/t7-/m0/s1
InChIKey QZZBJCFNHPYNKO-ZETCQYMHSA-N
Molecular Weight 138.228 g/mol
SMILES S[C@](c1ccccc1)(C)[H]
SPLASH splash10-0a4i-0900000000-299795881c70ccf386c8
Source of Spectrum J-44-4491-0
Wiley ID 1137907