| SpectraBase Spectrum ID |
18b8erbR3o |
| Name |
3-Cyano-1-(p-toluenesulfonyl)-4-(2-phenylethenyl)-1,3-butadiene |
| Alternate Name(s) |
(2Z,4E)-2-{(E)-2-[(4-methylphenyl)sulfonyl]ethenyl}-5-phenyl-2,4-pentadienenitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H17NO2S |
| InChI |
InChI=1S/C20H17NO2S/c1-17-10-12-20(13-11-17)24(22,23)15-14-19(16-21)9-5-8-18-6-3-2-4-7-18/h2-15H,1H3/b8-5+,15-14+,19-9- |
| InChIKey |
IESWAHPHZHMUJW-ABDPJLGLSA-N |
| Molecular Weight |
335.421 g/mol |
| SMILES |
c1(\C=C\C=C\(\C=C\S(=O)(=O)c2ccc(cc2)C)C#N)ccccc1 |
| SPLASH |
splash10-001r-0609000000-c41e584304a8e2637c74 |
| Source of Spectrum |
SO-0-965-2 |
| Wiley ID |
1538755 |
