SpectraBase Spectrum ID |
2nKFgfV3ju4 |
Name |
Mirtazapine-M (OH) |
Classification |
Pharmaceutical drug metabolite |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
281.152812243 u |
Formula |
C17H19N3O |
InChI |
InChI=1S/C17H19N3O/c1-19-8-9-20-15(11-19)14-5-3-2-4-12(14)10-13-6-7-16(21)18-17(13)20/h2-7,15H,8-11H2,1H3,(H,18,21) |
InChIKey |
WKBHWUSDTGYZBT-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
281.359 g/mol |
Nominal Mass |
281 u |
Quality |
836 |
Retention Index |
2368 |
SMILES |
OC1=NC=2N3C(C4=C(CC2C=C1)C=CC=C4)CN(CC3)C |
SPLASH |
splash10-03di-5590000000-9440bc7f1f3f567b0436 |
Sample Comments |
Hydroxyl position uncertain |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2-methyl-1,2,3,4,10,14b-hexahydropyrazino[2,1-a]pyrido[2,3-c][2]benzazepin-7-ol |
Technique |
GC/MS |
Wiley ID |
DD2024_002462 |