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

*Links on SpectraBase are not permalinks.
3-Cyclohexene-1-propanenitrile, 4-(2-methylpropoxy)-2-oxo-1-(2-propenyl)-, (.+-.)-
SpectraBase Compound ID AYm6IIli8ef
InChI InChI=1S/C16H23NO2/c1-4-7-16(8-5-10-17)9-6-14(11-15(16)18)19-12-13(2)3/h4,11,13H,1,5-9,12H2,2-3H3
InChIKey WBNYCSBFFXGYHI-UHFFFAOYSA-N
Mol Weight 261.36 g/mol
Molecular Formula C16H23NO2
Exact Mass 261.172879 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 E9EXnTbQUjc
Name 3-Cyclohexene-1-propanenitrile, 4-(2-methylpropoxy)-2-oxo-1-(2-propenyl)-, (.+-.)-
Alternate Name(s) 3-(1-allyl-4-isobutoxy-2-oxo-3-cyclohexen-1-yl)propanenitrile 6-Allyl-6-cyanoethyl-3-isobutoxy-cyclohexenone
CAS Registry Number 65310-38-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23NO2
InChI InChI=1S/C16H23NO2/c1-4-7-16(8-5-10-17)9-6-14(11-15(16)18)19-12-13(2)3/h4,11,13H,1,5-9,12H2,2-3H3
InChIKey WBNYCSBFFXGYHI-UHFFFAOYSA-N
Molecular Weight 261.365 g/mol
SMILES C=1C(C(CC=C)(CCC#N)CCC1OCC(C)C)=O
SPLASH splash10-0pb9-0790000000-dc98b5b94d903bb984ea
Source of Spectrum F-33-1648-0
Wiley ID 1264919