| SpectraBase Spectrum ID |
DjvYmRlGDOF |
| Name |
Isophthalic acid, isohexyl 4-tert-butylcyclohexyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
388.261359635 u |
| Formula |
C24H36O4 |
| InChI |
InChI=1S/C24H36O4/c1-17(2)8-7-15-27-22(25)18-9-6-10-19(16-18)23(26)28-21-13-11-20(12-14-21)24(3,4)5/h6,9-10,16-17,20-21H,7-8,11-15H2,1-5H3 |
| InChIKey |
PJJYXCZBSBYVKT-UHFFFAOYSA-N |
| Molecular Weight |
388.548 g/mol |
| SMILES |
CC(C1CCC(CC1)OC(C1=CC(=CC=C1)C(OCCCC(C)C)=O)=O)(C)C |
