SpectraBase Spectrum ID |
GmPzOKuxRcY |
Name |
4-Methoxybenzylamine, N-trifluoroacetyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
233.066363053 u |
Formula |
C10H10F3NO2 |
InChI |
InChI=1S/C10H10F3NO2/c1-16-8-4-2-7(3-5-8)6-14-9(15)10(11,12)13/h2-5H,6H2,1H3,(H,14,15) |
InChIKey |
QNFQVUUDXQXNQR-UHFFFAOYSA-N |
Molecular Weight |
233.190 g/mol |
SMILES |
C1=C(C=CC(=C1)OC)CNC(C(F)(F)F)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.801489 |