| SpectraBase Spectrum ID |
AiDi7HEPx5O |
| Name |
Desmedipham-M/A ME |
| CAS Registry Number |
2603-10-3 |
| Classification |
Drug metabolite, artifact |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
151.063328532 u |
| Formula |
C8H9NO2 |
| InChI |
InChI=1S/C8H9NO2/c1-11-8(10)9-7-5-3-2-4-6-7/h2-6H,1H3,(H,9,10) |
| InChIKey |
IAGUPODHENSJEZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
151.165 g/mol |
| Nominal Mass |
151 u |
| Quality |
980 |
| Retention Index |
1200 |
| SMILES |
C=1(NC(OC)=O)C=CC=CC1 |
| SPLASH |
splash10-1000-8900000000-692105446fec25d5807d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Phenyl-carbamic acid methyl ester |
| Technique |
GC/MS |
| Wiley ID |
DD2024_008462 |
