| SpectraBase Spectrum ID |
1slryevfdmq |
| Name |
(E)-2-(Benzoylamino)-3-(3,5-dimethyl-1H-pyrazol-4-yl)propenoic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H15N3O3 |
| InChI |
InChI=1S/C15H15N3O3/c1-9-12(10(2)18-17-9)8-13(15(20)21)16-14(19)11-6-4-3-5-7-11/h3-8H,1-2H3,(H,16,19)(H,17,18)(H,20,21)/b13-8+ |
| InChIKey |
NJMXBIAHKSKMAB-MDWZMJQESA-N |
| Molecular Weight |
285.303 g/mol |
| SMILES |
N(\C(C(=O)O)=C\c1c([nH]nc1C)C)C(=O)c1ccccc1 |
| SPLASH |
splash10-0a4i-0920000000-7733b5901cfc60131f07 |
| Source of Spectrum |
F-55-275-4 |
| Synonyms |
(2E)-2-(benzoylamino)-3-(3,5-dimethyl-1H-pyrazol-4-yl)-2-propenoic acid |
| Wiley ID |
836469 |
