| SpectraBase Spectrum ID |
B38G5o1u0Zs |
| Name |
Ethyl 2-(2-cyanoacetamido)-4-methyl-5-(phenylcarbamoyl)thiophene-3-carboxylate |
| Appearance |
Pale yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H17N3O4S |
| InChI |
InChI=1S/C18H17N3O4S/c1-3-25-18(24)14-11(2)15(26-17(14)21-13(22)9-10-19)16(23)20-12-7-5-4-6-8-12/h4-8H,3,9H2,1-2H3,(H,20,23)(H,21,22) |
| InChIKey |
PHCWNAUSXYDYQN-UHFFFAOYSA-N |
| Instrument Name |
Finnegan MAT 212 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2622 |
| Molecular Weight |
371.411 g/mol |
| SMILES |
N(C(c1c(c(c(s1)NC(CC#N)=O)C(OCC)=O)C)=O)c1ccccc1 |
| SPLASH |
splash10-03di-1593000000-6a1b919697a21d9e077c |
| Source of Spectrum |
Y-54-568-21 |
| Wiley ID |
1880700 |
