| SpectraBase Spectrum ID |
GYEZWUPf0Wu |
| Name |
Brotizolam-M (Hydroxymethyl) |
| Classification |
Pharmaceutical drug metabolite |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
407.944722831 u |
| Formula |
C15H10BrClN4OS |
| InChI |
InChI=1S/C15H10BrClN4OS/c16-11-5-9-14(8-3-1-2-4-10(8)17)18-6-12-19-20-13(7-22)21(12)15(9)23-11/h1-5,22H,6-7H2 |
| InChIKey |
SCENUYIFDLIXIB-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
409.689 g/mol |
| Nominal Mass |
408 u |
| Quality |
857 |
| Retention Index |
3065 |
| SMILES |
OCC=1N2C3=C(C(C=4C(=CC=CC4)Cl)=NCC2=NN1)C=C(S3)Br |
| SPLASH |
splash10-08fr-2975700000-3a8d84d727391fc6d8fc |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
(2-bromo-4-(2-chlorophenyl)-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepin-9-yl)methanol |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009253 |
