| SpectraBase Spectrum ID |
D65inoaItKJ |
| Name |
Benzamide, 3,4-dimethoxy-N-(2-pentyl)-N-dodecyl- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
419.339944310 u |
| Formula |
C26H45NO3 |
| InChI |
InChI=1S/C26H45NO3/c1-6-8-9-10-11-12-13-14-15-16-20-27(22(3)17-7-2)26(28)23-18-19-24(29-4)25(21-23)30-5/h18-19,21-22H,6-17,20H2,1-5H3 |
| InChIKey |
WKMALAAKAIGLMG-UHFFFAOYSA-N |
| Molecular Weight |
419.650 g/mol |
| SMILES |
C(N(CCCCCCCCCCCC)C(CCC)C)(=O)C=1C=C(C(=CC1)OC)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.940843 |
