| SpectraBase Spectrum ID |
6I6ILJH20NF |
| Name |
N,N'-bis(4'-Phenylbutyl)-N-{[3-(4''-phenylbutyl)amino]propyl}propane-1,3-diamine |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
527.423948719 u |
| Formula |
C36H53N3 |
| InChI |
InChI=1S/C36H53N3/c1-4-18-34(19-5-1)24-10-13-27-37-29-16-32-39(31-15-12-26-36-22-8-3-9-23-36)33-17-30-38-28-14-11-25-35-20-6-2-7-21-35/h1-9,18-23,37-38H,10-17,24-33H2 |
| InChIKey |
HSGMCWIRWSZCTH-UHFFFAOYSA-N |
| Molecular Weight |
527.841 g/mol |
| SMILES |
C(N(CCCNCCCCC=1C=CC=CC1)CCCCC1=CC=CC=C1)CCNCCCCC1=CC=CC=C1 |
![N,N'-bis(4'-Phenylbutyl)-N-{[3-(4''-phenylbutyl)amino]propyl}propane-1,3-diamine](/api/spectrum/6I6ILJH20NF/structure.png?h=300&w=458 "N,N'-bis(4'-Phenylbutyl)-N-{[3-(4''-phenylbutyl)amino]propyl}propane-1,3-diamine")
