SpectraBase Spectrum ID |
9o4n9wrnqn9 |
Name |
Benzenamine, 3-[[[3-(trifluoromethyl)phenyl]methoxy]methyl]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
281.102748563 u |
Formula |
C15H14F3NO |
InChI |
InChI=1S/C15H14F3NO/c16-15(17,18)13-5-1-3-11(7-13)9-20-10-12-4-2-6-14(19)8-12/h1-8H,9-10,19H2 |
InChIKey |
UKNYHVREXKVJMQ-UHFFFAOYSA-N |
Molecular Weight |
281.278 g/mol |
SMILES |
NC=1C=C(COCC2=CC=CC(=C2)C(F)(F)F)C=CC1 |
Spectrum/Structure Validation Score (Raman) |
0.879743 |