SpectraBase Spectrum ID |
BE68ZRrF64F |
Name |
Carbamazepine-M (OH) AC |
Classification |
Pharmaceutical drug metabolite |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
251.094628661 u |
Formula |
C16H13NO2 |
InChI |
InChI=1S/C16H13NO2/c1-11(18)19-16-10-12-6-2-4-8-14(12)17-15-9-5-3-7-13(15)16/h2-10,17H,1H3 |
InChIKey |
JEDJGKPDGJSRLX-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
251.285 g/mol |
Nominal Mass |
251 u |
Quality |
898 |
Retention Index |
2021 |
SMILES |
C=12C(NC3=C(C=C2OC(=O)C)C=CC=C3)=CC=CC1 |
SPLASH |
splash10-0a59-1890000000-e4cd61de6cb9c0a2bbbf |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
5H-Dibenzo[b,f]azepin-10-yl acetate |
Technique |
GC/MS |
Wiley ID |
DD2024_014270 |