| SpectraBase Spectrum ID |
GE2PTBFRG4K |
| Name |
Ethyl 2-cyano-3-( 4'-methylphenyl)-3-(heptylthio)propenoate |
| Alternate Name(s) |
Ethyl (2E)-2-cyano-3-(heptylsulfanyl)-3-(4-methylphenyl)-2-propenoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H27NO2S |
| InChI |
InChI=1S/C20H27NO2S/c1-4-6-7-8-9-14-24-19(17-12-10-16(3)11-13-17)18(15-21)20(22)23-5-2/h10-13H,4-9,14H2,1-3H3/b19-18+ |
| InChIKey |
NNLTWFJOLDEOCW-VHEBQXMUSA-N |
| Molecular Weight |
345.501 g/mol |
| SMILES |
c1(\C(=C/(C(=O)OCC)C#N)SCCCCCCC)ccc(cc1)C |
| SPLASH |
splash10-06rb-2492000000-955810f4e091aadc355b |
| Source of Spectrum |
SB-49-897-12 |
| Wiley ID |
1338716 |
