SpectraBase Spectrum ID |
2l99BnSEVGq |
Name |
Carbamazepine-M (Epoxide) |
Classification |
Pharmaceutical drug metabolite |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
252.089877632 u |
Formula |
C15H12N2O2 |
InChI |
InChI=1S/C15H12N2O2/c16-15(18)17-11-7-3-1-5-9(11)13-14(19-13)10-6-2-4-8-12(10)17/h1-8,13-14H,(H2,16,18) |
InChIKey |
ZRWWEEVEIOGMMT-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
252.273 g/mol |
Nominal Mass |
252 u |
Quality |
898 |
Retention Index |
2093 |
SMILES |
NC(N1C2=C(C3C(C=4C1=CC=CC4)O3)C=CC=C2)=O |
SPLASH |
splash10-0ue9-0960000000-6bc1e074968354e54de2 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
Carbamazepin-10,11-epoxide |
Technique |
GC/MS |
Wiley ID |
DD2024_000456 |