| SpectraBase Spectrum ID |
4zhzCPRMAca |
| Name |
N,N'-bis{[3-(2'-Phenylpropyl)amino]propyl}butane-1,4-diamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
438.372247497 u |
| Formula |
C28H46N4 |
| InChI |
InChI=1S/C28H46N4/c1-25(27-13-5-3-6-14-27)23-31-21-11-19-29-17-9-10-18-30-20-12-22-32-24-26(2)28-15-7-4-8-16-28/h3-8,13-16,25-26,29-32H,9-12,17-24H2,1-2H3 |
| InChIKey |
ZXKVOVNSLVUOFH-UHFFFAOYSA-N |
| Molecular Weight |
438.704 g/mol |
| SMILES |
C1(C(CNCCCNCCCCNCCCNCC(C=2C=CC=CC2)C)C)=CC=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.989663 |
![N,N'-bis{[3-(2'-Phenylpropyl)amino]propyl}butane-1,4-diamine](/api/spectrum/4zhzCPRMAca/structure.png?h=300&w=458 "N,N'-bis{[3-(2'-Phenylpropyl)amino]propyl}butane-1,4-diamine")
