| SpectraBase Spectrum ID |
6kV55iuVNCh |
| Name |
N-Heptyl-2-(2-[(heptyl-methyl-carbamoyl)-methoxy]-1-methyl-1,2-diphenyl-propoxy)-N-methyl-acetamide |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
580.424008287 u |
| Formula |
C36H56N2O4 |
| InChI |
InChI=1S/C36H56N2O4/c1-7-9-11-13-21-27-37(5)33(39)29-41-35(3,31-23-17-15-18-24-31)36(4,32-25-19-16-20-26-32)42-30-34(40)38(6)28-22-14-12-10-8-2/h15-20,23-26H,7-14,21-22,27-30H2,1-6H3 |
| InChIKey |
SIDJHGWATRVFTB-UHFFFAOYSA-N |
| Molecular Weight |
580.854 g/mol |
| SMILES |
C1=CC(C(C)(OCC(=O)N(C)CCCCCCC)C(C2=CC=CC=C2)(C)OCC(N(CCCCCCC)C)=O)=CC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966382 |
![N-Heptyl-2-(2-[(heptyl-methyl-carbamoyl)-methoxy]-1-methyl-1,2-diphenyl-propoxy)-N-methyl-acetamide](/api/spectrum/6kV55iuVNCh/structure.png?h=300&w=458 "N-Heptyl-2-(2-[(heptyl-methyl-carbamoyl)-methoxy]-1-methyl-1,2-diphenyl-propoxy)-N-methyl-acetamide")
