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

*Links on SpectraBase are not permalinks.
(1'R,2'S,4'S,2Z,4E)-5-(1',3',3'-Trimethyl-7'-oxabicyclo[2.2.1]hept-2'-yl)-3-methylpenta-2,4-dienenitrile
SpectraBase Compound ID 9n2NxN9J2nu
InChI InChI=1S/C15H21NO/c1-11(8-10-16)5-6-12-14(2,3)13-7-9-15(12,4)17-13/h5-6,8,12-13H,7,9H2,1-4H3/b6-5+,11-8-/t12-,13-,15+/m0/s1
InChIKey JZQCOIGJSCHDCV-KMOZYRHCSA-N
Mol Weight 231.34 g/mol
Molecular Formula C15H21NO
Exact Mass 231.162314 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 5vaUAIb9Hvs
Name (1'R,2'S,4'S,2Z,4E)-5-(1',3',3'-Trimethyl-7'-oxabicyclo[2.2.1]hept-2'-yl)-3-methylpenta-2,4-dienenitrile
Alternate Name(s) (2Z,4E)-3-methyl-5-[(1S,2S,4S)-1,3,3-trimethyl-7-oxabicyclo[2.2.1]hept-2-yl]-2,4-pentadienenitrile
CAS Registry Number 132168-51-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H21NO
InChI InChI=1S/C15H21NO/c1-11(8-10-16)5-6-12-14(2,3)13-7-9-15(12,4)17-13/h5-6,8,12-13H,7,9H2,1-4H3/b6-5+,11-8-/t12-,13-,15+/m0/s1
InChIKey JZQCOIGJSCHDCV-KMOZYRHCSA-N
Molecular Weight 231.339 g/mol
SMILES [C@@]12(O[C@@]([H])(CC2)C([C@@]1(\C=C\C(=C/C#N)C)[H])(C)C)C
SPLASH splash10-0ab9-0900000000-3075232747e21a4d8530
Source of Spectrum H-73-2197-9
Wiley ID 1233019