| SpectraBase Spectrum ID |
ENcc6lusnJ1 |
| Name |
Doxepine-M (Nor,OH) 2AC |
| Classification |
Pharmaceutical drug metabolite |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
365.162708221 u |
| Formula |
C22H23NO4 |
| InChI |
InChI=1S/C22H23NO4/c1-15(24)23(3)14-8-12-17-18-9-4-5-11-20(18)22(26-16(2)25)27-21-13-7-6-10-19(17)21/h4-7,9-13,22H,8,14H2,1-3H3/b17-12- |
| InChIKey |
RMGKXVQJGDTXPK-ATVHPVEESA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
365.429 g/mol |
| Nominal Mass |
365 u |
| Quality |
934 |
| Retention Index |
2787 |
| SMILES |
C=12\C(C3=C(OC(C2=CC=CC1)OC(=O)C)C=CC=C3)=C\CCN(C(=O)C)C |
| SPLASH |
splash10-0f80-1390000000-af51f6b4ba629d57af97 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(11Z)-11-(3-(acetyl(methyl)amino)propylidene)-6,11-dihydrodibenzo[b,e]oxepin-6-yl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_001254 |
