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1-Hexanol, 5-methyl-2-(phenylthio)-

View entire compound with spectra: 1 MS (GC)

1-Hexanol, 5-methyl-2-(phenylthio)-
SpectraBase Compound ID EIOmFImANJx
InChI InChI=1S/C13H20OS/c1-11(2)8-9-13(10-14)15-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3
InChIKey BALHUZIZYQQZQQ-UHFFFAOYSA-N
Mol Weight 224.36 g/mol
Molecular Formula C13H20OS
Exact Mass 224.123486 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FfRi9Qh4UYW
Name 1-Hexanol, 5-methyl-2-(phenylthio)-
Alternate Name(s) 5-Methyl-2-(phenylthio)hexan-1-ol 5-Methyl-2-(phenylthio)-1-hexanol 5-Methyl-2-phenylsulfanylhexan-1-ol
CAS Registry Number 61829-50-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20OS
InChI InChI=1S/C13H20OS/c1-11(2)8-9-13(10-14)15-12-6-4-3-5-7-12/h3-7,11,13-14H,8-10H2,1-2H3
InChIKey BALHUZIZYQQZQQ-UHFFFAOYSA-N
Molecular Weight 224.362 g/mol
SMILES OCC(CCC(C)C)Sc1ccccc1
SPLASH splash10-03kc-1930000000-b1f7d38c8dc625b2bb58
Source of Spectrum KC-1977-20-2280
Wiley ID 1225190