SpectraBase Spectrum ID |
1Nhdbxq9g0 |
Name |
alpha-Hydroxymidazolam BUT |
Classification |
Pharmaceutical drug derivative |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
411.114982725 u |
Formula |
C22H19ClFN3O2 |
InChI |
InChI=1S/C22H19ClFN3O2/c1-2-5-21(28)29-13-20-25-11-15-12-26-22(16-6-3-4-7-18(16)24)17-10-14(23)8-9-19(17)27(15)20/h3-4,6-11H,2,5,12-13H2,1H3 |
InChIKey |
AMHURNLCODGBSA-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
411.864 g/mol |
Nominal Mass |
411 u |
Quality |
933 |
Retention Index |
3237 |
SMILES |
C=12N3C(CN=C(C2=CC(=CC1)Cl)C1=C(C=CC=C1)F)=CN=C3COC(CCC)=O |
SPLASH |
splash10-01ox-1339000000-dbb165dbec201ad6331c |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(8-chloro-6-(2-fluorophenyl)-4H-imidazo[1,5-a][1,4]benzodiazepin-1-yl)methyl butanoate |
Technique |
GC/MS |
Wiley ID |
DD2024_011796 |