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

*Links on SpectraBase are not permalinks.
(+)-(1R,4R,7R)-7-Isopropyl-5-methyl-5-bicyclo[2.2.2]octen-2-one
SpectraBase Compound ID 9dn793BATAl
InChI InChI=1S/C12H18O/c1-7(2)10-5-9-6-12(13)11(10)4-8(9)3/h4,7,9-11H,5-6H2,1-3H3/t9-,10-,11+/m1/s1
InChIKey JGWYWWRNBCMLOE-MXWKQRLJSA-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 97wWeJkvoln
Name (+)-(1R,4R,7R)-7-Isopropyl-5-methyl-5-bicyclo[2.2.2]octen-2-one
CAS Registry Number 73069-42-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-7(2)10-5-9-6-12(13)11(10)4-8(9)3/h4,7,9-11H,5-6H2,1-3H3/t9-,10-,11+/m1/s1
InChIKey JGWYWWRNBCMLOE-MXWKQRLJSA-N
Molecular Weight 178.275 g/mol
SMILES [C@@]12(C=C(C)[C@](CC2=O)([H])C[C@@]1(C(C)C)[H])[H]
SPLASH splash10-0006-9200000000-90b91496470b93a5f6f3
Source of Spectrum H-62-2071-0
Synonyms (1R,4R,7R)-7-isopropyl-5-methylbicyclo[2.2.2]oct-5-en-2-one
Wiley ID 1174638