SpectraBase Spectrum ID |
JEbnIXDGuvY |
Name |
4-Fluoro-N-[2-(4-fluorophenyl)ethyl]-N-(3-iodobenzyl)aniline |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
449.045200910 u |
Formula |
C21H18F2IN |
InChI |
InChI=1S/C21H18F2IN/c22-18-6-4-16(5-7-18)12-13-25(21-10-8-19(23)9-11-21)15-17-2-1-3-20(24)14-17/h1-11,14H,12-13,15H2 |
InChIKey |
CWBISNHNVLADJN-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
449.283 g/mol |
Nominal Mass |
449 u |
Quality |
994 |
Retention Index |
2782 |
SMILES |
C=1(N(CC2=CC(=CC=C2)I)CCC=2C=CC(=CC2)F)C=CC(=CC1)F |
SPLASH |
splash10-00kf-5198000000-4e7ce7bc11fa84a648de |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Technique |
GC/MS |
Wiley ID |
DD2024_030640 |