SpectraBase Spectrum ID |
B29g25i21Ym |
Name |
4-Fluoro-N-([3-(trifluoromethyl)phenyl]methyl)aniline |
Classification |
Chemical |
Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
269.082762010 u |
Formula |
C14H11F4N |
InChI |
InChI=1S/C14H11F4N/c15-12-4-6-13(7-5-12)19-9-10-2-1-3-11(8-10)14(16,17)18/h1-8,19H,9H2 |
InChIKey |
BETOWJHBODQVFG-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
269.243 g/mol |
Nominal Mass |
269 u |
Quality |
999 |
Retention Index |
1683 |
SMILES |
C(C=1C=C(CNC=2C=CC(=CC2)F)C=CC1)(F)(F)F |
SPLASH |
splash10-06di-2960000000-c0c2e653c4d9f161cd5c |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
3-Trifluoromethylbenzylamine,N-(2-fluorophenyl)- |
Technique |
GC/MS |
Wiley ID |
DD2024_028336 |