| SpectraBase Spectrum ID |
DsjyXSWNDEZ |
| Name |
1,2-Cyclohexanedicarboxylic acid, 2-methoxyethyl octyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
342.240624190 u |
| Formula |
C19H34O5 |
| InChI |
InChI=1S/C19H34O5/c1-3-4-5-6-7-10-13-23-18(20)16-11-8-9-12-17(16)19(21)24-15-14-22-2/h16-17H,3-15H2,1-2H3 |
| InChIKey |
ZICMEDHZENCCEO-UHFFFAOYSA-N |
| Molecular Weight |
342.476 g/mol |
| SMILES |
C(C1CCCCC1C(OCCCCCCCC)=O)(=O)OCCOC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.914114 |
