| SpectraBase Spectrum ID |
Cbr8KD4yPca |
| Name |
3-Acetoxy-7-(non-5-en-5-yl)bicyclo[4.3.0]nona-4,7-diene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
302.224580204 u |
| Formula |
C20H30O2 |
| InChI |
InChI=1S/C20H30O2/c1-4-6-8-16(9-7-5-2)19-12-10-17-14-18(22-15(3)21)11-13-20(17)19/h8,11-13,17-18,20H,4-7,9-10,14H2,1-3H3/b16-8- |
| InChIKey |
IIZMQCVDTRUJMA-PXNMLYILSA-N |
| SMILES |
C=1(C2C=CC(CC2CC1)OC(=O)C)\C(=C/CCC)CCCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.908784 |
![3-Acetoxy-7-(non-5-en-5-yl)bicyclo[4.3.0]nona-4,7-diene](/api/spectrum/Cbr8KD4yPca/structure.png?h=300&w=458 "3-Acetoxy-7-(non-5-en-5-yl)bicyclo[4.3.0]nona-4,7-diene")
