| SpectraBase Spectrum ID |
ErZkVdX8QEh |
| Name |
Sebacic acid, 2,3-dimethylphenyl tetradecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
502.402210215 u |
| Formula |
C32H54O4 |
| InChI |
InChI=1S/C32H54O4/c1-4-5-6-7-8-9-10-11-12-15-18-21-27-35-31(33)25-19-16-13-14-17-20-26-32(34)36-30-24-22-23-28(2)29(30)3/h22-24H,4-21,25-27H2,1-3H3 |
| InChIKey |
NWGDIEYZLUMLST-UHFFFAOYSA-N |
| Molecular Weight |
502.780 g/mol |
| SMILES |
C(CCCCC(OC1=C(C(C)=CC=C1)C)=O)CCCC(OCCCCCCCCCCCCCC)=O |
