| SpectraBase Spectrum ID |
CSiEKpkKp6Z |
| Name |
cis-Cyclohex-4-en-1,2-dicarboxylic acid, di(2-ethylbutyl) ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.245709571 u |
| Formula |
C20H34O4 |
| InChI |
InChI=1S/C20H34O4/c1-5-15(6-2)13-23-19(21)17-11-9-10-12-18(17)20(22)24-14-16(7-3)8-4/h9-10,15-18H,5-8,11-14H2,1-4H3 |
| InChIKey |
OPEOWTAVQPVHHW-UHFFFAOYSA-N |
| Molecular Weight |
338.488 g/mol |
| SMILES |
C=1CC(C(CC1)C(OCC(CC)CC)=O)C(=O)OCC(CC)CC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.985249 |
