| SpectraBase Spectrum ID |
2f3JH1RdJMg |
| Name |
p-Heptyloxybenzylidene p-heptylaniline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
393.303164879 u |
| Formula |
C27H39NO |
| InChI |
InChI=1S/C27H39NO/c1-3-5-7-9-11-13-24-14-18-26(19-15-24)28-23-25-16-20-27(21-17-25)29-22-12-10-8-6-4-2/h14-21,23H,3-13,22H2,1-2H3/b28-23+ |
| InChIKey |
UGRAHPUNPGQELT-WEMUOSSPSA-N |
| Molecular Weight |
393.615 g/mol |
| SMILES |
C1=C(C=CC(=C1)CCCCCCC)\N=C\C=1C=CC(=CC1)OCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.964058 |
