| SpectraBase Spectrum ID |
6zgms2FYhgt |
| Name |
2-Methyl-4-nitrocarbanilic acid, isopropyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
238.095356935 u |
| Formula |
C11H14N2O4 |
| InChI |
InChI=1S/C11H14N2O4/c1-7(2)17-11(14)12-10-5-4-9(13(15)16)6-8(10)3/h4-7H,1-3H3,(H,12,14) |
| InChIKey |
PVMCVZMFGYHWLU-UHFFFAOYSA-N |
| Molecular Weight |
238.243 g/mol |
| SMILES |
N(=O)(=O)C=1C=C(C(=CC1)NC(OC(C)C)=O)C |
| Spectrum/Structure Validation Score (Raman) |
0.921087 |
