| SpectraBase Spectrum ID |
8IGiGI5ok3E |
| Name |
Metamizole-M (Bisnor,-CH2-SO3H) AC |
| Classification |
Pharmaceutical drug metabolite derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
231.100776669 u |
| Formula |
C12H13N3O2 |
| InChI |
InChI=1S/C12H13N3O2/c1-8-11(13-9(2)16)12(17)15(14-8)10-6-4-3-5-7-10/h3-7,14H,1-2H3,(H,13,16) |
| InChIKey |
SSFAVAJPXJFYHH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
231.255 g/mol |
| Nominal Mass |
231 u |
| Quality |
894 |
| Retention Index |
1987 |
| SMILES |
C1(N(NC(=C1NC(=O)C)C)C1=CC=CC=C1)=O |
| SPLASH |
splash10-053r-9030000000-93d65ed47241d1afbb2a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
N-(5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)acetamide |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001940 |
