| SpectraBase Spectrum ID |
ANzuOQjE9WL |
| Name |
Phthalic acid, dec-2-yl hexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
390.277009700 u |
| Formula |
C24H38O4 |
| InChI |
InChI=1S/C24H38O4/c1-4-6-8-10-11-12-16-20(3)28-24(26)22-18-14-13-17-21(22)23(25)27-19-15-9-7-5-2/h13-14,17-18,20H,4-12,15-16,19H2,1-3H3 |
| InChIKey |
HDKBVHRYUCGXQX-UHFFFAOYSA-N |
| Molecular Weight |
390.564 g/mol |
| SMILES |
C1=CC(=C(C=C1)C(OCCCCCC)=O)C(OC(C)CCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.894681 |
