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2-Cyclohexen-1-one, 3-isopropyl-5,5-dimethyl-
SpectraBase Compound ID DNpNDbVUBRd
InChI InChI=1S/C11H18O/c1-8(2)9-5-10(12)7-11(3,4)6-9/h5,8H,6-7H2,1-4H3
InChIKey MYUGFXPFGVRZED-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 FhNi88558Em
Name 2-Cyclohexen-1-one, 3-isopropyl-5,5-dimethyl-
CAS Registry Number 28017-79-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H18O
InChI InChI=1S/C11H18O/c1-8(2)9-5-10(12)7-11(3,4)6-9/h5,8H,6-7H2,1-4H3
InChIKey MYUGFXPFGVRZED-UHFFFAOYSA-N
Molecular Weight 166.264 g/mol
SMILES CC(C)C=1CC(C)(C)CC(C1)=O
SPLASH splash10-03yj-9300000000-9566ac747befb622037a
Source of Spectrum EP-2546-0-0
Synonyms 2-Cyclohexen-1-one, 5,5-dimethyl-3-(1-methylethyl)- 3-Isopropyl-5,5-dimethyl-2-cyclohexen-1-one 3-isopropyl-5,5-dimethyl-cyclohex-2-en-1-one 5,5-Dimethyl-3-propan-2-yl-1-cyclohex-2-enone 5,5-Dimethyl-3-propan-2-yl-cyclohex-2-en-1-one
Wiley ID 1162922