SpectraBase Spectrum ID |
LgXyk4kYiJs |
Name |
1-(2-Chlorophenyl)-N-(1-[4-(3-fluoropropoxy)-3,5-dimethoxyphenyl]propan-2-yl)methanimine |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
393.150699529 u |
Formula |
C21H25ClFNO3 |
InChI |
InChI=1S/C21H25ClFNO3/c1-15(24-14-17-7-4-5-8-18(17)22)11-16-12-19(25-2)21(20(13-16)26-3)27-10-6-9-23/h4-5,7-8,12-15H,6,9-11H2,1-3H3/b24-14+ |
InChIKey |
LVMYHQNTIBXMIM-ZVHZXABRSA-N |
Molecular Weight |
393.886 g/mol |
SMILES |
C1(=C(C=C(C=C1OC)CC(\N=C\C=1C(=CC=CC1)Cl)C)OC)OCCCF |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.934305 |