| SpectraBase Spectrum ID |
1aeLnAtzSy |
| Name |
Metronidazole-M (HO-methyl-) |
| Classification |
Antiamebic |
| Copyright |
Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
187.059305778 u |
| Formula |
C6H9N3O4 |
| InChI |
InChI=1S/C6H9N3O4/c1-12-4-8-5(9(10)11)3-7-6(8)13-2/h3H,4H2,1-2H3 |
| InChIKey |
ZRKYQVFVFOPTRP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
187.155 g/mol |
| SMILES |
c1([n](c(OC)nc1)COC)N(=O)=O |
| SPLASH |
splash10-0g4i-9700000000-75fb00ec4ca0a7c2f2c1 |
| 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. |
| 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_1830 |
