| SpectraBase Spectrum ID |
A2ym5qWa880 |
| Name |
4-Heptenoic acid, 6-acetylthio-5-cyano-7-phenyl-, methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19NO3S |
| InChI |
InChI=1S/C17H19NO3S/c1-13(19)22-16(11-14-7-4-3-5-8-14)15(12-18)9-6-10-17(20)21-2/h3-5,7-9,16H,6,10-11H2,1-2H3/b15-9+ |
| InChIKey |
OWJAPHMZCNFPEI-OQLLNIDSSA-N |
| Molecular Weight |
317.403 g/mol |
| SMILES |
c1(ccccc1)CC(SC(C)=O)\C(C#N)=C\CCC(=O)OC |
| SPLASH |
splash10-000x-5920000000-c3eee84808ad955ea2d6 |
| Synonyms |
(E)-6-(acetylthio)-5-cyano-7-phenyl-4-heptenoic acid methyl ester
(E)-6-(acetylthio)-5-cyano-7-phenyl-hept-4-enoic acid methyl ester
Methyl (4E)-6-(acetylsulfanyl)-5-cyano-7-phenyl-4-heptenoate
Methyl (E)-5-cyano-6-ethanoylsulfanyl-7-phenyl-hept-4-enoate
Methyl (E)-6-acetylsulfanyl-5-cyano-7-phenyl-hept-4-enoate |
| Wiley ID |
1479541 |
