| SpectraBase Spectrum ID |
K0ihPqlTWFf |
| Name |
Benzamide, 3-methoxy-N-(2-pentyl)-N-hexadecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
445.391979884 u |
| Formula |
C29H51NO2 |
| InChI |
InChI=1S/C29H51NO2/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-19-24-30(26(3)21-6-2)29(31)27-22-20-23-28(25-27)32-4/h20,22-23,25-26H,5-19,21,24H2,1-4H3 |
| InChIKey |
URZCAMQSIPKVII-UHFFFAOYSA-N |
| Molecular Weight |
445.732 g/mol |
| SMILES |
C(=O)(N(CCCCCCCCCCCCCCCC)C(CCC)C)C1=CC(=CC=C1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.842973 |
