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

*Links on SpectraBase are not permalinks.
Bicyclo[2.2.1]heptane-2-propanenitrile, 3-(bicyclo[2.2.1]hept-2-ylcarbonyl)-, [1.alpha.,2.alpha.,3.alpha.(1R*,2R*,4S*),4.alpha.]-
SpectraBase Compound ID KYhn1GdmfMb
InChI InChI=1S/C18H25NO/c19-7-1-2-15-13-5-6-14(10-13)17(15)18(20)16-9-11-3-4-12(16)8-11/h11-17H,1-6,8-10H2/t11-,12+,13-,14+,15+,16-,17-/m1/s1
InChIKey BVMBRAYXSLKOFK-ONNAEPBLSA-N
Mol Weight 271.4 g/mol
Molecular Formula C18H25NO
Exact Mass 271.193614 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 GW6vLpPY28s
Name Bicyclo[2.2.1]heptane-2-propanenitrile, 3-(bicyclo[2.2.1]hept-2-ylcarbonyl)-, [1.alpha.,2.alpha.,3.alpha.(1R*,2R*,4S*),4.alpha.]-
Alternate Name(s) (3exo-(2''-cyanoethyl)-norbornan-2exo-yl)-(norbornan-2'exo-yl)-ketone (3exo-(2''-Cyanoethyl)-norbornan-2exo-yl)-(norbornan-2'exo-yl)-ketone 3-[(1R,2S,3R,4S)-3-(bicyclo[2.2.1]hept-2-ylcarbonyl)bicyclo[2.2.1]hept-2-yl]propanenitrile
CAS Registry Number 67401-01-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H25NO
InChI InChI=1S/C18H25NO/c19-7-1-2-15-13-5-6-14(10-13)17(15)18(20)16-9-11-3-4-12(16)8-11/h11-17H,1-6,8-10H2/t11-,12+,13-,14+,15+,16-,17-/m1/s1
InChIKey BVMBRAYXSLKOFK-ONNAEPBLSA-N
Molecular Weight 271.404 g/mol
SMILES C([C@@]1([C@@]2(C[C@]([C@@]1(CCC#N)[H])(CC2)[H])[H])[H])([C@]1([C@@]2(C[C@](C1)(CC2)[H])[H])[H])=O
SPLASH splash10-0002-9410000000-09f508f65e73ce679cfa
Source of Spectrum H-61-1437-0
Wiley ID 1275500