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

*Links on SpectraBase are not permalinks.
(1R,6S)-N-(Cyanomethyl)-9-methoxy-5-azabenzo[b]tricyclo[4.4.0.3(1,6)]trideca-diene
SpectraBase Compound ID IzRDz7TeOe3
InChI InChI=1S/C19H24N2O/c1-22-15-6-5-14-12-18-16-4-2-3-7-19(16,17(14)13-15)8-10-21(18)11-9-20/h5-6,13,16,18H,2-4,7-8,10-12H2,1H3/t16?,18-,19-/m0/s1
InChIKey PHQXDWPBPROYJU-MSYFUGIWSA-N
Mol Weight 296.41 g/mol
Molecular Formula C19H24N2O
Exact Mass 296.188863 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 KIEpUCWFmTR
Name (1R,6S)-N-(Cyanomethyl)-9-methoxy-5-azabenzo[b]tricyclo[4.4.0.3(1,6)]trideca-diene
Alternate Name(s) (5S,10bR)-N-(Cyanomethyl)-9-methoxy-5-azabenzo[b]tricyclo[4.4.0.3(1,6)]trideca-diene N-(Cyanomethyl)-9-methoxy-5-azabenzo[b]tricyclo[4.4.0.3(1,6)]trideca-diene [(9alpha,13alpha)-3-methoxymorphinan-17-yl]acetonitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H24N2O
InChI InChI=1S/C19H24N2O/c1-22-15-6-5-14-12-18-16-4-2-3-7-19(16,17(14)13-15)8-10-21(18)11-9-20/h5-6,13,16,18H,2-4,7-8,10-12H2,1H3/t16?,18-,19-/m0/s1
InChIKey PHQXDWPBPROYJU-MSYFUGIWSA-N
Molecular Weight 296.414 g/mol
SMILES [C@]123c4c(ccc(c4)OC)C[C@@](C1CCCC2)(N(CC3)CC#N)[H]
SPLASH splash10-03di-0090000000-3bb10df7cd6f14fee225
Source of Spectrum AT-31-4738-5
Wiley ID 835751