| SpectraBase Spectrum ID |
BIbr0AweF6o |
| Name |
N,N'-Diheptyl-m-phenylene-dimethanamine |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
332.319149296 u |
| Formula |
C22H40N2 |
| InChI |
InChI=1S/C22H40N2/c1-3-5-7-9-11-16-23-19-21-14-13-15-22(18-21)20-24-17-12-10-8-6-4-2/h13-15,18,23-24H,3-12,16-17,19-20H2,1-2H3 |
| InChIKey |
YLEDIYQAYWIGMT-UHFFFAOYSA-N |
| Molecular Weight |
332.576 g/mol |
| SMILES |
C=1(CNCCCCCCC)C=C(CNCCCCCCC)C=CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.973901 |
