| SpectraBase Spectrum ID |
JjlZ3I8HVrX |
| Name |
2-Methylbenzylamine, N,N-didecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
401.402150646 u |
| Formula |
C28H51N |
| InChI |
InChI=1S/C28H51N/c1-4-6-8-10-12-14-16-20-24-29(26-28-23-19-18-22-27(28)3)25-21-17-15-13-11-9-7-5-2/h18-19,22-23H,4-17,20-21,24-26H2,1-3H3 |
| InChIKey |
XSBMQDSWCGXPHE-UHFFFAOYSA-N |
| Molecular Weight |
401.723 g/mol |
| SMILES |
C1=CC(C)=C(C=C1)CN(CCCCCCCCCC)CCCCCCCCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.900484 |
