SpectraBase Spectrum ID |
JEmPqJ0bnY8 |
Name |
Carbamazepine-M (Oxo,enol) AC |
Classification |
Pharmaceutical drug metabolite |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
294.100442316 u |
Formula |
C17H14N2O3 |
InChI |
InChI=1S/C17H14N2O3/c1-11(20)22-16-10-12-6-2-4-8-14(12)19(17(18)21)15-9-5-3-7-13(15)16/h2-10H,1H3,(H2,18,21) |
InChIKey |
BRJIUIARAQMVID-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
294.310 g/mol |
Nominal Mass |
294 u |
Quality |
914 |
Retention Index |
2352 |
SMILES |
NC(N1C=2C(C(=CC3=C1C=CC=C3)OC(=O)C)=CC=CC2)=O |
SPLASH |
splash10-0a4i-0490000000-95e7d64bd558ffb3c78b |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
5-carbamoyl-5H-dibenzo[b,f]azepin-10-yl acetate |
Technique |
GC/MS |
Wiley ID |
DD2024_000453 |