| SpectraBase Spectrum ID |
JdOhfNgrICO |
| Name |
Carbamazepine-M (Oxo,enol) AC |
| 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 |
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 |
906 |
| Retention Index |
2352 |
| SMILES |
NC(N1C=2C(C(=CC3=C1C=CC=C3)OC(=O)C)=CC=CC2)=O |
| SPLASH |
splash10-0pc0-1890000000-8a5f5844e75a1f4c4ddb |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
5-carbamoyl-5H-dibenzo[b,f]azepin-10-yl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000454 |
