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

*Links on SpectraBase are not permalinks.
(1RS,3RS,4SR)-1,4-DIMETHYL-3-(PROP-2'-ENYL)-BICYCLO-[2.2.2]-OCT-5-EN-2-ONE
SpectraBase Compound ID BMv9hxj6r5b
InChI InChI=1S/C13H18O/c1-4-5-10-11(14)13(3)8-6-12(10,2)7-9-13/h4,6,8,10H,1,5,7,9H2,2-3H3/t10-,12-,13+/m0/s1
InChIKey XYDPCDCQZDIAJO-WCFLWFBJSA-N
Mol Weight 190.29 g/mol
Molecular Formula C13H18O
Exact Mass 190.135765 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 8o9hn4TR9y4
Name Bicyclo[2.2.2]oct-5-en-2-one, 1,4-dimethyl-3-(2-propenyl)-, (1.alpha.,3.beta.,4.alpha.)-(.+-.)-
CAS Registry Number 124016-95-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H18O
InChI InChI=1S/C13H18O/c1-4-5-10-11(14)13(3)8-6-12(10,2)7-9-13/h4,6,8,10H,1,5,7,9H2,2-3H3/t10-,12-,13+/m0/s1
InChIKey XYDPCDCQZDIAJO-WCFLWFBJSA-N
Molecular Weight 190.286 g/mol
SMILES C1([C@@]2(C=C[C@]([C@]1(CC=C)[H])(CC2)C)C)=O
SPLASH splash10-0a4l-6900000000-0afcdf1610229e90441a
Source of Spectrum H-72-586-14
Synonyms (1RS,3RS,4SR)-1,4-dimethyl-3-(prop-2'-enyl)bicyclo[2.2.2]oct-5-ene-2-one (1S,3R,4R)-3-allyl-1,4-dimethylbicyclo[2.2.2]oct-5-en-2-one
Wiley ID 1187022