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2-Cyclohexen-1-one, 5-(1-methylethyl)-2-(2-methylpropyl)-
SpectraBase Compound ID 6rNs5mQzOWR
InChI InChI=1S/C13H22O/c1-9(2)7-12-6-5-11(10(3)4)8-13(12)14/h6,9-11H,5,7-8H2,1-4H3
InChIKey RRVUWHZNUXPZBP-UHFFFAOYSA-N
Mol Weight 194.32 g/mol
Molecular Formula C13H22O
Exact Mass 194.167065 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EWPOfSKykLG
Name 2-Cyclohexen-1-one, 5-(1-methylethyl)-2-(2-methylpropyl)-
Alternate Name(s) 2-isobutyl-5-isopropyl-2-cyclohexen-1-one 5-Isopropyl-2-(2-methylpropyl)-2-cyclohexen-1-one
CAS Registry Number 79862-15-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H22O
InChI InChI=1S/C13H22O/c1-9(2)7-12-6-5-11(10(3)4)8-13(12)14/h6,9-11H,5,7-8H2,1-4H3
InChIKey RRVUWHZNUXPZBP-UHFFFAOYSA-N
Molecular Weight 194.318 g/mol
SMILES C=1(C(CC(CC1)C(C)C)=O)CC(C)C
SPLASH splash10-007o-9800000000-b9b4c514012b64c76021
Source of Spectrum H-64-1492-0
Wiley ID 1191370