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

*Links on SpectraBase are not permalinks.
(1R,2R,4S,6S,8S)-8-ISOPROPYL-2,6-DIMETHYL-5-OXOBICYCLO-[2.2.2]-OCTANE-2-CARBOXYLIC-ACID
SpectraBase Compound ID 2XylDmJalfJ
InChI InChI=1S/C14H22O3/c1-7(2)9-5-11-8(3)12(15)10(9)6-14(11,4)13(16)17/h7-11H,5-6H2,1-4H3,(H,16,17)/t8-,9-,10-,11+,14+/m0/s1
InChIKey BKASBOMQMRFTBB-MOUCOTEISA-N
Mol Weight 238.33 g/mol
Molecular Formula C14H22O3
Exact Mass 238.156895 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 BwEQJ1IXiJB
Name (-)-(1S,3R,6R,7S,9S)-9-Isopropyl-3,6-dimethyltricyclo[4.3.1.0(3,7)]decane-2-one-5-carboxylic acid
Alternate Name(s) (1S,2R,6S,8S)-8-isopropyl-2,6-dimethyl-5-oxobicyclo[2.2.2]octane-2-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H22O3
InChI InChI=1S/C14H22O3/c1-7(2)9-5-11-8(3)12(15)10(9)6-14(11,4)13(16)17/h7-11H,5-6H2,1-4H3,(H,16,17)/t8-,9-,10-,11+,14+/m0/s1
InChIKey BKASBOMQMRFTBB-MOUCOTEISA-N
Molecular Weight 238.327 g/mol
SMILES OC([C@]1([C@]2([C@](C)(C([C@@](C1)([C@](C(C)C)(C2)[H])[H])=O)[H])[H])C)=O
SPLASH splash10-0a4i-0900000000-696310abb6287641b551
Source of Spectrum J-66-4383-11
Wiley ID 1535459