| SpectraBase Spectrum ID |
7VG9RSWrAcc |
| Name |
Adipic acid, .beta.-citronellyl hexadecyl ester |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
508.449160408 u |
| Formula |
C32H60O4 |
| InChI |
InChI=1S/C32H60O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20-27-35-31(33)24-18-19-25-32(34)36-28-26-30(4)23-21-22-29(2)3/h22,30H,5-21,23-28H2,1-4H3 |
| InChIKey |
JQSQWXAQJLXEFS-UHFFFAOYSA-N |
| Molecular Weight |
508.828 g/mol |
| SMILES |
C(CCCC(OCCC(C)CCC=C(C)C)=O)C(OCCCCCCCCCCCCCCCC)=O |
