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6-Methyl-5-hepten-2-one
SpectraBase Compound ID ly0hJBX17N
InChI InChI=1S/C8H14O/c1-7(2)5-4-6-8(3)9/h5H,4,6H2,1-3H3
InChIKey UHEPJGULSIKKTP-UHFFFAOYSA-N
Mol Weight 126.2 g/mol
Molecular Formula C8H14O
Exact Mass 126.104465 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LizqQTqxa2R
Name 6-methyl-5-hepten-2-one
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 126.104465070 u
Formula C8H14O
InChI InChI=1S/C8H14O/c1-7(2)5-4-6-8(3)9/h5H,4,6H2,1-3H3
InChIKey UHEPJGULSIKKTP-UHFFFAOYSA-N
Instrument Name Agilent 6890N-5973
Ionization Type EI
Literature Reference DOI 10.1002/jsfa.10023
Molecular Weight 126.199 g/mol
Number of Peaks 4
SMILES CC(CCC=C(C)C)=O
SPLASH splash10-0a4i-9600000000-321f1db2f02e2dcc098e
Source of Spectrum SFA-100-947-Table 1-6 (DOI: 10.1002/jsfa.10023)
Wiley ID 1838727