| SpectraBase Spectrum ID |
EN84kW1yRRk |
| Name |
Succinic acid, 2-ethylhexyl cis-4-tert-butylcyclohexyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
368.292659764 u |
| Formula |
C22H40O4 |
| InChI |
InChI=1S/C22H40O4/c1-6-8-9-17(7-2)16-25-20(23)14-15-21(24)26-19-12-10-18(11-13-19)22(3,4)5/h17-19H,6-16H2,1-5H3 |
| InChIKey |
FZUKCLZQTYFCQV-UHFFFAOYSA-N |
| Molecular Weight |
368.558 g/mol |
| SMILES |
C(CC(OCC(CC)CCCC)=O)C(OC1CCC(C(C)(C)C)CC1)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.913448 |
