![(E)-2-cyano-N-[4-(aminosulfonyl) phenyl]-3-(4-(piperidin-1-yl)phenyl)acrylamide](/api/spectrum/2DSanXWnMAM/structure.png?h=300&w=458 "(E)-2-cyano-N-[4-(aminosulfonyl) phenyl]-3-(4-(piperidin-1-yl)phenyl)acrylamide")
| SpectraBase Compound ID | I8zK4KKsJYp |
|---|---|
| InChI | InChI=1S/C21H22N4O3S/c22-15-17(21(26)24-18-6-10-20(11-7-18)29(23,27)28)14-16-4-8-19(9-5-16)25-12-2-1-3-13-25/h4-11,14H,1-3,12-13H2,(H,24,26)(H2,23,27,28)/b17-14+ |
| InChIKey | UINVQRCWMMFQAZ-SAPNQHFASA-N |
| Mol Weight | 410.49 g/mol |
| Molecular Formula | C21H22N4O3S |
| Exact Mass | 410.141262 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2DSanXWnMAM |
|---|---|
| Name | (E)-2-cyano-N-[4-(aminosulfonyl) phenyl]-3-(4-(piperidin-1-yl)phenyl)acrylamide |
| Appearance | Orange crystals |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H22N4O3S |
| InChI | InChI=1S/C21H22N4O3S/c22-15-17(21(26)24-18-6-10-20(11-7-18)29(23,27)28)14-16-4-8-19(9-5-16)25-12-2-1-3-13-25/h4-11,14H,1-3,12-13H2,(H,24,26)(H2,23,27,28)/b17-14+ |
| InChIKey | UINVQRCWMMFQAZ-SAPNQHFASA-N |
| Instrument Name | JEOL-JMS 600 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1002/jhet.2576 |
| Molecular Weight | 410.492 g/mol |
| SMILES | N(C(\C(C#N)=C\c1ccc(cc1)N1CCCCC1)=O)c1ccc(S(N)(=O)=O)cc1 |
| SPLASH | splash10-059i-9620000000-d144dd010a7ca3fa43a0 |
| Source of Spectrum | Y-54-274-20 |
| Wiley ID | 1877801 |