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

*Links on SpectraBase are not permalinks.
(E)-(6S)-6-(2,4-Dichlorobenzoyloxy)-2-((diphenylmethylene)amino)hept-4-enenitrile
SpectraBase Compound ID G03VS7GJO3Q
InChI InChI=1S/C27H22Cl2N2O2/c1-19(33-27(32)24-16-15-22(28)17-25(24)29)9-8-14-23(18-30)31-26(20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-13,15-17,19,23H,14H2,1H3/b9-8+/t19-,23?/m0/s1
InChIKey FDTVMDVIVMTLEB-FNMCRTMUSA-N
Mol Weight 477.39 g/mol
Molecular Formula C27H22Cl2N2O2
Exact Mass 476.105833 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 8S2JUlbmjSZ
Name (E)-(6S)-6-(2,4-Dichlorobenzoyloxy)-2-((diphenylmethylene)amino)hept-4-enenitrile
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H22Cl2N2O2
InChI InChI=1S/C27H22Cl2N2O2/c1-19(33-27(32)24-16-15-22(28)17-25(24)29)9-8-14-23(18-30)31-26(20-10-4-2-5-11-20)21-12-6-3-7-13-21/h2-13,15-17,19,23H,14H2,1H3/b9-8+/t19-,23?/m0/s1
InChIKey FDTVMDVIVMTLEB-FNMCRTMUSA-N
Molecular Weight 477.391 g/mol
SMILES c1(C(O[C@](\C=C\CC(N=C(c2ccccc2)c2ccccc2)C#N)(C)[H])=O)c(cc(cc1)Cl)Cl
SPLASH splash10-014i-0900200000-64d252274ec49df3f3c7
Source of Spectrum J-64-4723-21
Synonyms (1S,2E)-5-cyano-5-[(diphenylmethylene)amino]-1-methyl-2-pentenyl 2,4-dichlorobenzoate
Wiley ID 1530526