| SpectraBase Spectrum ID |
FnjMimFh0Dt |
| Name |
3-Cyclopentylpropionic acid, 4-tetradecyl ester |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.318480590 u |
| Formula |
C22H42O2 |
| InChI |
InChI=1S/C22H42O2/c1-3-5-6-7-8-9-10-11-17-21(14-4-2)24-22(23)19-18-20-15-12-13-16-20/h20-21H,3-19H2,1-2H3 |
| InChIKey |
MFQXGJPBQRKZPO-UHFFFAOYSA-N |
| Molecular Weight |
338.576 g/mol |
| SMILES |
C1CC(CCC(OC(CCCCCCCCCC)CCC)=O)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.815391 |
