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2-Methylhexanal
SpectraBase Compound ID F2VepRxcdIV
InChI InChI=1S/C7H14O/c1-3-4-5-7(2)6-8/h6-7H,3-5H2,1-2H3
InChIKey BHVGMUDWABJNRC-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 JzkP0mJfHiO
Name Hexanal, 2-methyl-
CAS Registry Number 925-54-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H14O
InChI InChI=1S/C7H14O/c1-3-4-5-7(2)6-8/h6-7H,3-5H2,1-2H3
InChIKey BHVGMUDWABJNRC-UHFFFAOYSA-N
Molecular Weight 114.188 g/mol
SMILES C(=O)C(C)CCCC
SPLASH splash10-0a4l-9000000000-ea74f0e5e26420505be5
Source of Spectrum SD-1981-0-0
Synonyms 2-Methylhexanal 2-Methylhexanaldehyde EINECS 213-118-4
Wiley ID 1124597