| SpectraBase Spectrum ID |
GbGns4su2cQ |
| Name |
Nimesulide |
| CAS Registry Number |
51803-78-2 |
| Classification |
Pharmaceutical drug, non-steroidal anti-inflammatory (NSAID) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
308.046692663 u |
| Formula |
C13H12N2O5S |
| InChI |
InChI=1S/C13H12N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h2-9,14H,1H3 |
| InChIKey |
HYWYRSMBCFDLJT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
308.308 g/mol |
| Nominal Mass |
308 u |
| Quality |
997 |
| Retention Index |
2335 |
| SMILES |
C=1(C(=CC(=CC1)[N+](=O)[O-])OC1=CC=CC=C1)NS(=O)(=O)C |
| SPLASH |
splash10-0kdi-3943000000-146cb2c7569750fc557b |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(4-Nitro-2-phenoxyphenyl)methanesulfonamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_030415 |
