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3-Isopropenyl-6-methyl-5-hepten-2-one
SpectraBase Compound ID 5CX4MBdEP9s
InChI InChI=1S/C11H18O/c1-8(2)6-7-11(9(3)4)10(5)12/h6,11H,3,7H2,1-2,4-5H3
InChIKey KGXRMGREKQQQPZ-UHFFFAOYSA-N
Mol Weight 166.26 g/mol
Molecular Formula C11H18O
Exact Mass 166.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EIX7r7AfG8V
Name 3-Isopropenyl-6-methyl-5-hepten-2-one
Alternate Name(s) 3-isopropenyl-6-methyl-hept-5-en-2-one 6-Methyl-3-(1-methylethenyl)-5-hepten-2-one 6-Methyl-3-prop-1-en-2-yl-hept-5-en-2-one
CAS Registry Number 26533-38-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O
InChI InChI=1S/C11H18O/c1-8(2)6-7-11(9(3)4)10(5)12/h6,11H,3,7H2,1-2,4-5H3
InChIKey KGXRMGREKQQQPZ-UHFFFAOYSA-N
Molecular Weight 166.264 g/mol
SMILES C(CC=C(C)C)(C(=C)C)C(=O)C
SPLASH splash10-00rx-9200000000-8e32033c6b1b9b0e0bef
Source of Spectrum H-63-582-22
Wiley ID 1162881