| SpectraBase Spectrum ID |
FoghCTab0yj |
| Name |
Cyclopropanedecanoic acid, 2-octyl-, methyl 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/c1-3-4-5-6-10-13-16-20-19-21(20)17-14-11-8-7-9-12-15-18-22(23)24-2/h20-21H,3-19H2,1-2H3 |
| InChIKey |
MOTIPGVOEIQBHG-UHFFFAOYSA-N |
| Molecular Weight |
338.576 g/mol |
| SMILES |
C(CC1C(CCCCCCCC)C1)CCCCCCCC(OC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.802614 |
