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Hexanal, 5-methyl-
SpectraBase Compound ID Fy1lVlY0guJ
InChI InChI=1S/C7H14O/c1-7(2)5-3-4-6-8/h6-7H,3-5H2,1-2H3
InChIKey GEKRISJWBAIIAA-UHFFFAOYSA-N
Mol Weight 114.19 g/mol
Molecular Formula C7H14O
Exact Mass 114.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 46xkmKx3po
Name Hexanal, 5-methyl-
CAS Registry Number 1860-39-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14O
InChI InChI=1S/C7H14O/c1-7(2)5-3-4-6-8/h6-7H,3-5H2,1-2H3
InChIKey GEKRISJWBAIIAA-UHFFFAOYSA-N
Molecular Weight 114.188 g/mol
SMILES C(CCC=O)C(C)C
SPLASH splash10-0596-9000000000-921da59fc5e98bc465f9
Source of Spectrum J-59-2963-8
Synonyms 5-Methylhexanal 5-Methylhexan-1-al
Wiley ID 1124602