| SpectraBase Spectrum ID |
H56ng9fUQF9 |
| Name |
Metronidazole-M (HO-methyl-) AC |
| Classification |
Antiamebic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
229.069870461 u |
| Formula |
C8H11N3O5 |
| InChI |
InChI=1S/C8H11N3O5/c1-6(13)16-3-2-10-7(5-12)9-4-8(10)11(14)15/h4,12H,2-3,5H2,1H3 |
| InChIKey |
KGGXEPGNGMWSAC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
229.192 g/mol |
| SMILES |
c1([n](CCOC(=O)C)c(CO)nc1)N(=O)=O |
| SPLASH |
splash10-000i-9300000000-0d2e931f3f94a12a70e1 |
| Sample Comments |
The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database. |
| Sample Preparation Procedure |
Detected: U+UHYAC |
| Source of Spectrum |
H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany |
| Technique |
GC/MS |
| Wiley ID |
MMPW6e_1831 |
