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(rac)-4-Phenylbutane-2-thiol

View entire compound with spectra: 1 MS (GC)

(rac)-4-Phenylbutane-2-thiol
SpectraBase Compound ID Gjckighdwd4
InChI InChI=1S/C10H14S/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3
InChIKey ONUUVTXZBYMCLC-UHFFFAOYSA-N
Mol Weight 166.28 g/mol
Molecular Formula C10H14S
Exact Mass 166.081622 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3dFfwRm80ss
Name (rac)-4-Phenylbutane-2-thiol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H14S
InChI InChI=1S/C10H14S/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3
InChIKey ONUUVTXZBYMCLC-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo402246h
Molecular Weight 166.282 g/mol
SMILES SC(CCc1ccccc1)C
SPLASH splash10-014l-9600000000-c9c23de1ed42a9d0d1d9
Source of Spectrum J-78-12608-7
Synonyms 4-Phenylbutane-2-thiol 4-Phenyl-2-butanethiol
Wiley ID 1747400