For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
7-Amino-Flunitrazepam TFA
SpectraBase Compound ID CABccS1CINd
InChI InChI=1S/C18H13F4N3O2/c1-25-14-7-6-10(24-17(27)18(20,21)22)8-12(14)16(23-9-15(25)26)11-4-2-3-5-13(11)19/h2-8H,9H2,1H3,(H,24,27)
InChIKey DHWYSMASZLUINX-UHFFFAOYSA-N
Mol Weight 379.31 g/mol
Molecular Formula C18H13F4N3O2
Exact Mass 379.094389 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8GU2xSRlcWm
Name 7-Amino-Flunitrazepam TFA
Classification Pharmaceutical drug metabolite derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 379.094389321 u
Formula C18H13F4N3O2
InChI InChI=1S/C18H13F4N3O2/c1-25-14-7-6-10(24-17(27)18(20,21)22)8-12(14)16(23-9-15(25)26)11-4-2-3-5-13(11)19/h2-8H,9H2,1H3,(H,24,27)
InChIKey DHWYSMASZLUINX-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 379.315 g/mol
Nominal Mass 379 u
Quality 961
Retention Index 3020
SMILES C1=2C(C=3C(=CC=CC3)F)=NCC(N(C1=CC=C(C2)NC(C(F)(F)F)=O)C)=O
SPLASH splash10-0gdi-8975000000-10ebd1a0f29fd0fea53e
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms trifluoro-N-(5-(2-fluorophenyl)-1-methyl-2-oxo-2,3-dihydro-1H-1,4-benzodiazepin-7-yl)acetamide
Technique GC/MS
Wiley ID DD2024_000090