SpectraBase Spectrum ID |
6zRhpvDnxEn |
Name |
3-Fluoro-N-(3-iodobenzyl)aniline |
Classification |
Chemical |
Copyright |
Copyright © 2024-2025 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
326.992022521 u |
Formula |
C13H11FIN |
InChI |
InChI=1S/C13H11FIN/c14-11-4-2-6-13(8-11)16-9-10-3-1-5-12(15)7-10/h1-8,16H,9H2 |
InChIKey |
AYURQOATHVXRRT-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
327.141 g/mol |
Nominal Mass |
327 u |
Quality |
991 |
Retention Index |
2124 |
SMILES |
C1(NCC2=CC(=CC=C2)I)=CC(=CC=C1)F |
SPLASH |
splash10-00or-9558000000-0b302f85d1aaeb1f9b1e |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Technique |
GC/MS |
Wiley ID |
DD2024_028462 |