| SpectraBase Spectrum ID |
8FqcbRXWOe0 |
| Name |
Phenytoin-M 2ME |
| CAS Registry Number |
54833-61-3 |
| Classification |
Pharmaceutical drug metabolite |
| 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 |
296.116092380 u |
| Formula |
C17H16N2O3 |
| InChI |
InChI=1S/C17H16N2O3/c1-19-15(20)17(18-16(19)21,12-6-4-3-5-7-12)13-8-10-14(22-2)11-9-13/h3-11H,1-2H3,(H,18,21) |
| InChIKey |
NNGQATKQKQJSKA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
296.326 g/mol |
| Nominal Mass |
296 u |
| Quality |
909 |
| Retention Index |
2399 |
| SMILES |
C1(C(N(C(N1)=O)C)=O)(C=1C=CC(=CC1)OC)C=1C=CC=CC1 |
| SPLASH |
splash10-015a-2690000000-e2d0815899479cbc3bac |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
5-(4-Methoxyphenyl)-3-methyl-5-phenyl-2,4-imidazolidione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_003622 |
