| SpectraBase Spectrum ID |
CPmGtRQaX7E |
| Name |
2-[(2,3-Dimethylquinoxalin-6-yl)carbamoyl]cyclohexane-1-carboxylic acid |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
327.158291545 u |
| Formula |
C18H21N3O3 |
| InChI |
InChI=1S/C18H21N3O3/c1-10-11(2)20-16-9-12(7-8-15(16)19-10)21-17(22)13-5-3-4-6-14(13)18(23)24/h7-9,13-14H,3-6H2,1-2H3,(H,21,22)(H,23,24) |
| InChIKey |
RJMREODRLBVJHL-UHFFFAOYSA-N |
| Molecular Weight |
327.384 g/mol |
| SMILES |
C1CCC(C(=O)NC2=CC=C3C(=C2)N=C(C(=N3)C)C)C(C1)C(O)=O |