| SpectraBase Spectrum ID |
8J3o4k2MkIy |
| Name |
Nor-Flunitrazepam-A HFB |
| Classification |
Pharmaceutical drug metabolite, artifact derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
452.040717427 u |
| Formula |
C18H8F8N2O3 |
| InChI |
InChI=1S/C18H8F8N2O3/c19-13-4-2-1-3-10(13)12-8-27(14-6-5-9(28(30)31)7-11(12)14)15(29)16(20,21)17(22,23)18(24,25)26/h1-8H |
| InChIKey |
IMTYXEOOGJIHIG-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
452.260 g/mol |
| Nominal Mass |
452 u |
| Quality |
972 |
| Retention Index |
3390 |
| SMILES |
C(C(C(N1C=2C(C(C=3C(=CC=CC3)F)=C1)=CC(=CC2)[N+](=O)[O-])=O)(F)F)(C(F)(F)F)(F)F |
| SPLASH |
splash10-053r-1490100000-2d925b65048371a6fcb3 |
| Sample Comments |
Structure uncertain |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2,2,3,3,4,4,4-heptafluoro-1-(3-(2-fluorophenyl)-5-nitro-1H-indol-1-yl)butan-1-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_011913 |
