| SpectraBase Spectrum ID |
Ju3d4CEggAr |
| Name |
(1R,2S)-1,2-bis(4-Methylphenyl)-N,N'-bis(prop-2-enyl)ethane-1,2-diamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
320.225248910 u |
| Formula |
C22H28N2 |
| InChI |
InChI=1S/C22H28N2/c1-5-15-23-21(19-11-7-17(3)8-12-19)22(24-16-6-2)20-13-9-18(4)10-14-20/h5-14,21-24H,1-2,15-16H2,3-4H3/t21-,22+ |
| InChIKey |
CQPGGTDICVQYOB-SZPZYZBQSA-N |
| Molecular Weight |
320.480 g/mol |
| SMILES |
[C@@]([C@](C1=CC=C(C=C1)C)(NCC=C)[H])(C=1C=CC(=CC1)C)(NCC=C)[H] |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.968834 |
