SpectraBase Spectrum ID |
Go3owPAuos9 |
Name |
2-Methylbenzylamine, N,N-dinonyl- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
373.370850517 u |
Formula |
C26H47N |
InChI |
InChI=1S/C26H47N/c1-4-6-8-10-12-14-18-22-27(23-19-15-13-11-9-7-5-2)24-26-21-17-16-20-25(26)3/h16-17,20-21H,4-15,18-19,22-24H2,1-3H3 |
InChIKey |
QSJSYDAIXDWCFD-UHFFFAOYSA-N |
Molecular Weight |
373.669 g/mol |
SMILES |
C1=CC(C)=C(C=C1)CN(CCCCCCCCC)CCCCCCCCC |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.932132 |