| SpectraBase Spectrum ID |
JT5LK7mXTd5 |
| Name |
(1R*,3R*)-N,N'-bis(2,4,6-Trimethylphenylmethyl)-1,3-diphenyl-1,3-propanediamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
490.334799360 u |
| Formula |
C35H42N2 |
| InChI |
InChI=1S/C35H42N2/c1-24-17-26(3)32(27(4)18-24)22-36-34(30-13-9-7-10-14-30)21-35(31-15-11-8-12-16-31)37-23-33-28(5)19-25(2)20-29(33)6/h7-20,34-37H,21-23H2,1-6H3/t34-,35-/m0/s1 |
| InChIKey |
FQALNAZKNABRDX-PXLJZGITSA-N |
| Molecular Weight |
490.735 g/mol |
| SMILES |
C1(=C(C=C(C=C1C)C)C)CN[C@@](C[C@](NCC=1C(=CC(=CC1C)C)C)(C=1C=CC=CC1)[H])(C1=CC=CC=C1)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.82278 |
