| SpectraBase Spectrum ID |
D5tiCbm7WIi |
| Name |
(E)-4-(2-Bromobenzyl)-2-(N-methylanilino)-6-phenylthiohexa-2,4-dienenitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H23BrN2S |
| InChI |
InChI=1S/C26H23BrN2S/c1-29(23-11-4-2-5-12-23)24(20-28)19-21(18-22-10-8-9-15-26(22)27)16-17-30-25-13-6-3-7-14-25/h2-16,19H,17-18H2,1H3/b21-16+,24-19+ |
| InChIKey |
AIGNYJNCEXFPCN-LHAZJVNNSA-N |
| Molecular Weight |
475.448 g/mol |
| SMILES |
C(\C(\C=C/(N(c1ccccc1)C)C#N)=C\CSc1ccccc1)c1c(Br)cccc1 |
| SPLASH |
splash10-0a4i-0009000000-93b838aadce8d019c42c |
| Source of Spectrum |
KC-1992-3092-35 |
| Synonyms |
(2E,4E)-4-(2-bromobenzyl)-2-(methylanilino)-6-(phenylsulfanyl)-2,4-hexadienenitrile |
| Wiley ID |
777394 |
