| SpectraBase Spectrum ID |
A18xJJ1bKYQ |
| Name |
Phthalic acid, monoamide, N,N-dioctyl, isohexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
473.386894503 u |
| Formula |
C30H51NO3 |
| InChI |
InChI=1S/C30H51NO3/c1-5-7-9-11-13-17-23-31(24-18-14-12-10-8-6-2)29(32)27-21-15-16-22-28(27)30(33)34-25-19-20-26(3)4/h15-16,21-22,26H,5-14,17-20,23-25H2,1-4H3 |
| InChIKey |
BTGGOVGKSJDFRV-UHFFFAOYSA-N |
| Molecular Weight |
473.742 g/mol |
| SMILES |
CC(C)CCCOC(C1=C(C(N(CCCCCCCC)CCCCCCCC)=O)C=CC=C1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.806019 |
