For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
4-Cyclohepten-1-one, 3,3-dimethyl-6-(1-methylethenyl)-
SpectraBase Compound ID BHFQ7b5TEej
InChI InChI=1S/C12H18O/c1-9(2)10-5-6-12(3,4)8-11(13)7-10/h5-6,10H,1,7-8H2,2-4H3
InChIKey KBIYBBVFKDOSMN-UHFFFAOYSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 1W8rogRh9qs
Name 4-Cyclohepten-1-one, 3,3-dimethyl-6-(1-methylethenyl)-
Alternate Name(s) 3,3-Dimethyl-6-(1'-methylvinyl)-4-cycloheptnone 6-isopropenyl-3,3-dimethyl-4-cyclohepten-1-one
CAS Registry Number 102635-48-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-9(2)10-5-6-12(3,4)8-11(13)7-10/h5-6,10H,1,7-8H2,2-4H3
InChIKey KBIYBBVFKDOSMN-UHFFFAOYSA-N
Molecular Weight 178.275 g/mol
SMILES C=1C(C(=C)C)CC(=O)CC(C1)(C)C
SPLASH splash10-0096-9400000000-8f9fcf7be70524abfdf0
Source of Spectrum H-68-1105-63
Wiley ID 1174707