SpectraBase Spectrum ID |
8dpPieu7mry |
Name |
cis-Cyclohex-4-en-1,2-dicarboxylic acid, 2-ethylhexyl octyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
394.308309828 u |
Formula |
C24H42O4 |
InChI |
InChI=1S/C24H42O4/c1-4-7-9-10-11-14-18-27-23(25)21-16-12-13-17-22(21)24(26)28-19-20(6-3)15-8-5-2/h12-13,20-22H,4-11,14-19H2,1-3H3 |
InChIKey |
AGLFVKJEDRJRQO-UHFFFAOYSA-N |
Molecular Weight |
394.596 g/mol |
SMILES |
C=1CC(C(CC1)C(OCC(CCCC)CC)=O)C(=O)OCCCCCCCC |