| SpectraBase Spectrum ID |
4DpfelJhpAN |
| Name |
N-(3,4-Dimethoxybenzylidene)-1,1,1-trifluoro-3-phenyl-isopropylamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
337.128963311 u |
| Formula |
C18H18F3NO2 |
| InChI |
InChI=1S/C18H18F3NO2/c1-23-15-9-8-14(10-16(15)24-2)12-22-17(18(19,20)21)11-13-6-4-3-5-7-13/h3-10,12,17H,11H2,1-2H3/b22-12+ |
| InChIKey |
PVUWOWFKRIHOFJ-WSDLNYQXSA-N |
| Molecular Weight |
337.342 g/mol |
| SMILES |
C(C(\N=C\C1=CC(OC)=C(C=C1)OC)CC=1C=CC=CC1)(F)(F)F |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.868211 |
