| SpectraBase Spectrum ID |
AaLXSTyyfCc |
| Name |
Isophthalic acid, di(oct-3-en-2-yl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
386.245709571 u |
| Formula |
C24H34O4 |
| InChI |
InChI=1S/C24H34O4/c1-5-7-9-11-14-19(3)27-23(25)21-16-13-17-22(18-21)24(26)28-20(4)15-12-10-8-6-2/h11-20H,5-10H2,1-4H3/b14-11+,15-12+ |
| InChIKey |
UJQJWYDVNCDQCN-LCPPQYOVSA-N |
| Molecular Weight |
386.532 g/mol |
| SMILES |
C1=C(C=CC=C1C(OC(C)\C=C\CCCC)=O)C(OC(\C=C\CCCC)C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.95014 |
