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1-Hexanol, 3-methyl-
SpectraBase Compound ID 4wUgUxygORz
InChI InChI=1S/C7H16O/c1-3-4-7(2)5-6-8/h7-8H,3-6H2,1-2H3
InChIKey YGZVAQICDGBHMD-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 J0g0Rwqvnhf
Name 1-Hexanol, 3-methyl-
CAS Registry Number 13231-81-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H16O
InChI InChI=1S/C7H16O/c1-3-4-7(2)5-6-8/h7-8H,3-6H2,1-2H3
InChIKey YGZVAQICDGBHMD-UHFFFAOYSA-N
Molecular Weight 116.204 g/mol
SMILES OCCC(CCC)C
SPLASH splash10-0a4l-9000000000-d68dfe177d643e37b44b
Source of Spectrum AA-0-439-3
Synonyms 3-Methyl-1-hexanol 3-Methylhexan-1-ol 3-Methylhexanol
Wiley ID 1125935