| SpectraBase Spectrum ID |
GYlUnwniFXM |
| Name |
Nitrazepam |
| CAS Registry Number |
146-22-5 |
| Classification |
Pharmaceutical drug, hypnotic |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found); Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
281.080041223 u |
| Formula |
C15H11N3O3 |
| InChI |
InChI=1S/C15H11N3O3/c19-14-9-16-15(10-4-2-1-3-5-10)12-8-11(18(20)21)6-7-13(12)17-14/h1-8H,9H2,(H,17,19) |
| InChIKey |
KJONHKAYOJNZEC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
281.271 g/mol |
| Nominal Mass |
281 u |
| Quality |
954 |
| Retention Index |
2750 |
| SMILES |
C1=2C(C3=CC=CC=C3)=NCC(NC1=CC=C(C2)[N+](=O)[O-])=O |
| SPLASH |
splash10-0kai-1390000000-499aab324273b0839718 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Mogadan
9-Nitro-6-phenyl-2,5-diazabicyclo[5.4.0]undeca-5,8,10,12-tetraen-3-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_022317 |
