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5-Hepten-2-ol, 6-methyl-3-(phenylthio)-
SpectraBase Compound ID AManS8ZHcBE
InChI InChI=1S/C14H20OS/c1-11(2)9-10-14(12(3)15)16-13-7-5-4-6-8-13/h4-9,12,14-15H,10H2,1-3H3
InChIKey QEAZQILUOSRCEN-UHFFFAOYSA-N
Mol Weight 236.37 g/mol
Molecular Formula C14H20OS
Exact Mass 236.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KgBsWLp5Vb6
Name 5-Hepten-2-ol, 6-methyl-3-(phenylthio)-
CAS Registry Number 108362-41-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H20OS
InChI InChI=1S/C14H20OS/c1-11(2)9-10-14(12(3)15)16-13-7-5-4-6-8-13/h4-9,12,14-15H,10H2,1-3H3
InChIKey QEAZQILUOSRCEN-UHFFFAOYSA-N
Molecular Weight 236.373 g/mol
SMILES OC(C(Sc1ccccc1)CC=C(C)C)C
SPLASH splash10-015a-3920000000-def70113b72ed3af2edd
Source of Spectrum KC-1986-1701-42
Synonyms 6-Methyl-3-(phenylsulfanyl)-5-hepten-2-ol 6-Methyl-3-phenylthiohept-5-en-2-ol
Wiley ID 1238297