| SpectraBase Spectrum ID |
IeSp0xnk5HK |
| Name |
Dimetridazole |
| CAS Registry Number |
551-92-8 |
| Classification |
Pharmaceutical drug, antiprotozoal |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
141.053826475 u |
| Formula |
C5H7N3O2 |
| InChI |
InChI=1S/C5H7N3O2/c1-4-6-3-5(7(4)2)8(9)10/h3H,1-2H3 |
| InChIKey |
IBXPYPUJPLLOIN-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
141.130 g/mol |
| Nominal Mass |
141 u |
| Quality |
804 |
| Retention Index |
1353 |
| SMILES |
C=1(N(C(=NC1)C)C)[N+](=O)[O-] |
| SPLASH |
splash10-0udm-9400000000-07c136d04ff9772ad0d8 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1,2-Dimethyl-5-nitroimidazole |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007873 |
