SpectraBase Spectrum ID |
8HXSR6o9V6u |
Name |
Pyrazolam |
CAS Registry Number |
39243-02-2 |
Classification |
Designer drug, anxiolytic |
Comments |
Spectrum verified by independent measurements in external laboratories |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
353.027608406 u |
Formula |
C16H12BrN5 |
InChI |
InChI=1S/C16H12BrN5/c1-10-20-21-15-9-19-16(13-4-2-3-7-18-13)12-8-11(17)5-6-14(12)22(10)15/h2-8H,9H2,1H3 |
InChIKey |
BGRWSFIQQPVEML-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
354.211 g/mol |
Nominal Mass |
353 u |
Quality |
998 |
Retention Index |
3029 |
SMILES |
C=12N3C(CN=C(C2=CC(=CC1)Br)C1=NC=CC=C1)=NN=C3C |
SPLASH |
splash10-0pb9-2597000000-46604765914380c7535e |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
8-Bromo-1-methyl-6-(pyridin-2-yl)-4H-benzo[f][1,2,4]triazolo[4,3-a][1,4]diazepine |
Technique |
GC/MS |
Wiley ID |
DD2024_022568 |