| SpectraBase Spectrum ID |
C78y866xOcn |
| Name |
Isobornyl caprate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
308.271530397 u |
| Formula |
C20H36O2 |
| InChI |
InChI=1S/C20H36O2/c1-5-6-7-8-9-10-11-12-18(21)22-17-15-16-13-14-20(17,4)19(16,2)3/h16-17H,5-15H2,1-4H3/t16-,17?,20+/m1/s1 |
| InChIKey |
JZDLFGOESWNMDS-ZYLKAMJESA-N |
| Molecular Weight |
308.506 g/mol |
| SMILES |
C1(C[C@]2(CC[C@]1(C)C2(C)C)[H])OC(CCCCCCCCC)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.899626 |
