SpectraBase Spectrum ID |
HpHEngee7ZY |
Name |
Mirtazapine-M (Nor,OH) 2AC |
Classification |
Pharmaceutical drug metabolite |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
351.158291545 u |
Formula |
C20H21N3O3 |
InChI |
InChI=1S/C20H21N3O3/c1-13(24)22-9-10-23-18(12-22)17-6-4-3-5-15(17)11-16-7-8-19(21-20(16)23)26-14(2)25/h3-8,18H,9-12H2,1-2H3 |
InChIKey |
GJQBKVUENCBSTG-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
351.406 g/mol |
Nominal Mass |
351 u |
Quality |
885 |
Retention Index |
2862 |
SMILES |
C12N(C3=C(CC4=C2C=CC=C4)C=CC(=N3)OC(=O)C)CCN(C1)C(=O)C |
SPLASH |
splash10-0wmi-1591000000-620831ef4cf5f8d9180f |
Sample Comments |
Structure uncertain |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2-acetyl-1,2,3,4,10,14b-hexahydropyrazino[2,1-a]pyrido[2,3-c][2]benzazepin-7-yl acetate |
Technique |
GC/MS |
Wiley ID |
DD2024_002461 |