| SpectraBase Spectrum ID |
A7IbCClYrO0 |
| Name |
1,4-Benzenediamine, 2-methyl-N4,N4-dioctyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.334799360 u |
| Formula |
C23H42N2 |
| InChI |
InChI=1S/C23H42N2/c1-4-6-8-10-12-14-18-25(19-15-13-11-9-7-5-2)22-16-17-23(24)21(3)20-22/h16-17,20H,4-15,18-19,24H2,1-3H3 |
| InChIKey |
AJMBJVRRWLOXHB-UHFFFAOYSA-N |
| Molecular Weight |
346.603 g/mol |
| SMILES |
CCCCCCCCN(CCCCCCCC)C1=CC=C(C(=C1)C)N |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.955121 |
