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5-Hexen-2-one, 3,4,4-trimethyl-
SpectraBase Compound ID 2YwYA6Qn0ws
InChI InChI=1S/C9H16O/c1-6-9(4,5)7(2)8(3)10/h6-7H,1H2,2-5H3
InChIKey BNVIKAHIWGIGDR-UHFFFAOYSA-N
Mol Weight 140.23 g/mol
Molecular Formula C9H16O
Exact Mass 140.120115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BbAfUGXFkzo
Name 5-Hexen-2-one, 3,4,4-trimethyl-
Alternate Name(s) 3,4,4-Trimethyl-5-hexen-2-one
CAS Registry Number 54678-05-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O
InChI InChI=1S/C9H16O/c1-6-9(4,5)7(2)8(3)10/h6-7H,1H2,2-5H3
InChIKey BNVIKAHIWGIGDR-UHFFFAOYSA-N
Molecular Weight 140.226 g/mol
SMILES C(C(C(=O)C)C)(C=C)(C)C
SPLASH splash10-00kf-9000000000-6a8f389d867fd02bccfe
Source of Spectrum J-40-1467-0
Wiley ID 1139628