SpectraBase Spectrum ID |
4pPJTYcZn6 |
Name |
Alprazolam-M (alpha OH) |
Classification |
Pharmaceutical drug metabolite |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
324.077788754 u |
Formula |
C17H13ClN4O |
InChI |
InChI=1S/C17H13ClN4O/c18-12-6-7-14-13(8-12)17(11-4-2-1-3-5-11)19-9-15-20-21-16(10-23)22(14)15/h1-8,23H,9-10H2 |
InChIKey |
ZURUZYHEEMDQBU-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
324.771 g/mol |
Nominal Mass |
324 u |
Quality |
929 |
Retention Index |
2694 |
SMILES |
OCC=1N2C=3C(C(C=4C=CC=CC4)=NCC2=NN1)=CC(=CC3)Cl |
SPLASH |
splash10-0a4l-1390000000-6dfe9e0a94590cf6e397 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
8-Chloro-6-phenyl-4H-S-triazolo[4,3-a][1,4]-benzodiazepin-1-methanol |
Technique |
GC/MS |
Wiley ID |
DD2024_000070 |