| SpectraBase Spectrum ID |
7xK6rcyEXG5 |
| Name |
Phthalic acid, monoamide, N,N-diundecyl, isobutyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
529.449494761 u |
| Formula |
C34H59NO3 |
| InChI |
InChI=1S/C34H59NO3/c1-5-7-9-11-13-15-17-19-23-27-35(28-24-20-18-16-14-12-10-8-6-2)33(36)31-25-21-22-26-32(31)34(37)38-29-30(3)4/h21-22,25-26,30H,5-20,23-24,27-29H2,1-4H3 |
| InChIKey |
BDLQNVHJYMIBLH-UHFFFAOYSA-N |
| Molecular Weight |
529.850 g/mol |
| SMILES |
CC(C)COC(C1=C(C(N(CCCCCCCCCCC)CCCCCCCCCCC)=O)C=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.860816 |
