SpectraBase Spectrum ID |
2lMO0iIpCJk |
Name |
N-3-Fluorobenzyl-N,N-bis(3-iodobenzyl)amine |
Classification |
Chemical |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
556.951267747 u |
Formula |
C21H18FI2N |
InChI |
InChI=1S/C21H18FI2N/c22-19-7-1-4-16(10-19)13-25(14-17-5-2-8-20(23)11-17)15-18-6-3-9-21(24)12-18/h1-12H,13-15H2 |
InChIKey |
NKMYCYYWFCASHQ-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
557.189 g/mol |
Nominal Mass |
557 u |
Quality |
987 |
Retention Index |
3037 |
SMILES |
C(N(CC=1C=C(C=CC1)I)CC1=CC(=CC=C1)I)C=1C=C(C=CC1)F |
SPLASH |
splash10-00kf-6559110000-aa7753227aff71793cdb |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
(3-fluorophenyl)-N,N-bis(3-iodobenzyl)methanamine |
Technique |
GC/MS |
Wiley ID |
DD2024_020457 |