| SpectraBase Spectrum ID |
8S2JUlbmjSZ |
| Name |
(E)-(6S)-6-(2,4-Dichlorobenzoyloxy)-2-((diphenylmethylene)amino)hept-4-enenitrile |
| Alternate Name(s) |
(1S,2E)-5-cyano-5-[(diphenylmethylene)amino]-1-methyl-2-pentenyl 2,4-dichlorobenzoate |
| 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 |
| Wiley ID |
1530526 |
