| SpectraBase Spectrum ID |
rdWDCaOjhP |
| Name |
Phthalic acid, monoamide, N,N-dinonyl, isohexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
501.418194632 u |
| Formula |
C32H55NO3 |
| InChI |
InChI=1S/C32H55NO3/c1-5-7-9-11-13-15-19-25-33(26-20-16-14-12-10-8-6-2)31(34)29-23-17-18-24-30(29)32(35)36-27-21-22-28(3)4/h17-18,23-24,28H,5-16,19-22,25-27H2,1-4H3 |
| InChIKey |
PVXVTEDVGNWBRD-UHFFFAOYSA-N |
| Molecular Weight |
501.796 g/mol |
| SMILES |
CC(C)CCCOC(C1=C(C(N(CCCCCCCCC)CCCCCCCCC)=O)C=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.839999 |
