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3-(Methylthio)-1-hexanol
SpectraBase Compound ID 8qGi9aiPpEv
InChI InChI=1S/C7H16OS/c1-3-4-7(9-2)5-6-8/h7-8H,3-6H2,1-2H3
InChIKey JSASXSHMJYRPCM-UHFFFAOYSA-N
Mol Weight 148.26 g/mol
Molecular Formula C7H16OS
Exact Mass 148.092186 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hgh16oJhx77
Name 1-Hexanol, 3-(methylthio)-
Alternate Name(s) 3-(methylmercapto)-1-hexanol 3-(Methylthio)-1-hexanol 3-(methylthio)hexan-1-ol 3-(Methylthio)hexanol 3-Methylsulfanylhexan-1-ol AI3-37114 EINECS 257-380-8 FEMA NO. 3438
CAS Registry Number 51755-66-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H16OS
InChI InChI=1S/C7H16OS/c1-3-4-7(9-2)5-6-8/h7-8H,3-6H2,1-2H3
InChIKey JSASXSHMJYRPCM-UHFFFAOYSA-N
Molecular Weight 148.264 g/mol
SMILES OCCC(SC)CCC
SPLASH splash10-0a59-9100000000-012b38251039028e77a3
Source of Spectrum H-59-1614-3
Wiley ID 9548