| SpectraBase Spectrum ID |
LJPw3SuhWlQ |
| Name |
1,2-Cyclohexanedicarboxylic acid, 3,5-dimethylphenyl pentadecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
486.370910086 u |
| Formula |
C31H50O4 |
| InChI |
InChI=1S/C31H50O4/c1-4-5-6-7-8-9-10-11-12-13-14-15-18-21-34-30(32)28-19-16-17-20-29(28)31(33)35-27-23-25(2)22-26(3)24-27/h22-24,28-29H,4-21H2,1-3H3 |
| InChIKey |
ARWFZOWRCXHPFK-UHFFFAOYSA-N |
| Molecular Weight |
486.737 g/mol |
| SMILES |
C1(=CC(=CC(=C1)C)C)OC(C1CCCCC1C(OCCCCCCCCCCCCCCC)=O)=O |
