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3-Hexanol, 3-methyl-
SpectraBase Compound ID 3IRotuKnl77
InChI InChI=1S/C7H16O/c1-4-6-7(3,8)5-2/h8H,4-6H2,1-3H3
InChIKey KYWJZCSJMOILIZ-UHFFFAOYSA-N
Mol Weight 116.2 g/mol
Molecular Formula C7H16O
Exact Mass 116.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3ekfzBkKmzy
Name 3-Hexanol, 3-methyl-
Alternate Name(s) 2-Ethyl-2-pentanol 3-Methyl-3-hexanol 3-Methyl-hexanol-(3) 3-Methylhexan-3-ol BRN 1719032 EINECS 209-910-4 NSC 27229
CAS Registry Number 597-96-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H16O
InChI InChI=1S/C7H16O/c1-4-6-7(3,8)5-2/h8H,4-6H2,1-3H3
InChIKey KYWJZCSJMOILIZ-UHFFFAOYSA-N
Molecular Weight 116.204 g/mol
SMILES OC(C)(CCC)CC
SPLASH splash10-00dj-9000000000-6c867ef89e94c98f109d
Source of Spectrum HE-1982-0-0
Wiley ID 1125949