| SpectraBase Spectrum ID |
uTmeQlcjTk |
| Name |
Phthalic acid, monoamide, N,N-diundecyl, propyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
515.433844696 u |
| Formula |
C33H57NO3 |
| InChI |
InChI=1S/C33H57NO3/c1-4-7-9-11-13-15-17-19-23-27-34(28-24-20-18-16-14-12-10-8-5-2)32(35)30-25-21-22-26-31(30)33(36)37-29-6-3/h21-22,25-26H,4-20,23-24,27-29H2,1-3H3 |
| InChIKey |
RXFYIBJUNLXSLM-UHFFFAOYSA-N |
| Molecular Weight |
515.823 g/mol |
| SMILES |
C(CCCCCCCCCN(C(C1=C(C(OCCC)=O)C=CC=C1)=O)CCCCCCCCCCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.92295 |
