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3,6-Dimethyl-5-hepten-2-one
SpectraBase Compound ID GKorr1V5PDY
InChI InChI=1S/C9H16O/c1-7(2)5-6-8(3)9(4)10/h5,8H,6H2,1-4H3
InChIKey GFFWTYGLHZTFHM-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 LsloPVKEYhK
Name 3,6-Dimethyl-5-hepten-2-one
Alternate Name(s) 3,6-Dimethylhept-5-en-2-one 5-Hepten-2-one, 3,6-dimethyl- EINECS 212-086-9
CAS Registry Number 124017-06-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O
InChI InChI=1S/C9H16O/c1-7(2)5-6-8(3)9(4)10/h5,8H,6H2,1-4H3
InChIKey GFFWTYGLHZTFHM-UHFFFAOYSA-N
Molecular Weight 140.226 g/mol
SMILES C(=O)(C(CC=C(C)C)C)C
SPLASH splash10-0a4i-9100000000-5f6b6582839387ca672b
Source of Spectrum H-72-589-39
Wiley ID 1139765