SpectraBase Spectrum ID |
CIMosFFy66R |
Name |
cis-Cyclohex-4-en-1,2-dicarboxylic acid, decyl octyl ester |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
422.339609957 u |
Formula |
C26H46O4 |
InChI |
InChI=1S/C26H46O4/c1-3-5-7-9-11-12-14-18-22-30-26(28)24-20-16-15-19-23(24)25(27)29-21-17-13-10-8-6-4-2/h15-16,23-24H,3-14,17-22H2,1-2H3 |
InChIKey |
GXHYAJTZVGEJQT-UHFFFAOYSA-N |
Molecular Weight |
422.650 g/mol |
SMILES |
C=1CC(C(CC1)C(OCCCCCCCCCC)=O)C(=O)OCCCCCCCC |