SpectraBase Spectrum ID |
JHPCRr4MuIK |
Name |
Flecainide |
CAS Registry Number |
54143-55-4 |
Classification |
Pharmaceutical drug, antiarrhythmic |
Comments |
Spectrum verified by crosschecking against external libraries (three 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 |
414.137811487 u |
Formula |
C17H20F6N2O3 |
InChI |
InChI=1S/C17H20F6N2O3/c18-16(19,20)9-27-12-4-5-14(28-10-17(21,22)23)13(7-12)15(26)25-8-11-3-1-2-6-24-11/h4-5,7,11,24H,1-3,6,8-10H2,(H,25,26) |
InChIKey |
DJBNUMBKLMJRSA-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
414.348 g/mol |
Nominal Mass |
414 u |
Quality |
937 |
Retention Index |
3154 |
SMILES |
C=1(C(=CC=C(C1)OCC(F)(F)F)OCC(F)(F)F)C(NCC1NCCCC1)=O |
SPLASH |
splash10-001i-9100000000-a90ad70b224b210602c6 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
N-(piperidin-2-ylmethyl)-2,5-bis(2,2,2-trifluoroethoxy)benzamide |
Technique |
GC/MS |
Wiley ID |
DD2024_007225 |