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Benzenemethanol, .alpha.-[3-[(4-methylphenyl)thio]propyl]-, stereoisomer
SpectraBase Compound ID EqPwm5qHBxv
InChI InChI=1S/C17H20OS/c1-14-9-11-16(12-10-14)19-13-5-8-17(18)15-6-3-2-4-7-15/h2-4,6-7,9-12,17-18H,5,8,13H2,1H3
InChIKey LGOHOOHVEGHPEY-UHFFFAOYSA-N
Mol Weight 272.41 g/mol
Molecular Formula C17H20OS
Exact Mass 272.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GNxCOsZpNCR
Name Benzenemethanol, .alpha.-[3-[(4-methylphenyl)thio]propyl]-, stereoisomer
CAS Registry Number 78086-43-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20OS
InChI InChI=1S/C17H20OS/c1-14-9-11-16(12-10-14)19-13-5-8-17(18)15-6-3-2-4-7-15/h2-4,6-7,9-12,17-18H,5,8,13H2,1H3
InChIKey LGOHOOHVEGHPEY-UHFFFAOYSA-N
Molecular Weight 272.406 g/mol
SMILES OC(c1ccccc1)CCCSc1ccc(cc1)C
SPLASH splash10-05i0-4910000000-b032ea6a2d85d9106c8c
Source of Spectrum B-33-2651-0
Synonyms 4-(p-methylphenylthio)-1-phenylbutan-1-ol 4-[(4-methylphenyl)sulfanyl]-1-phenyl-1-butanol
Wiley ID 1276416