| SpectraBase Spectrum ID |
8NuyGMXNowD |
| Name |
1,2-Cyclohexanedicarboxylic acid, 2,5-dimethylphenyl isobutyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
332.198759378 u |
| Formula |
C20H28O4 |
| InChI |
InChI=1S/C20H28O4/c1-13(2)12-23-19(21)16-7-5-6-8-17(16)20(22)24-18-11-14(3)9-10-15(18)4/h9-11,13,16-17H,5-8,12H2,1-4H3 |
| InChIKey |
UPXGABJZXBUCMD-UHFFFAOYSA-N |
| Molecular Weight |
332.440 g/mol |
| SMILES |
CC(C)COC(C1C(C(=O)OC2=CC(=CC=C2C)C)CCCC1)=O |
