| SpectraBase Spectrum ID |
2dCFQPd30RA |
| Name |
6-Acetoxy-1,4-dimethylbicyclo[3.2.0]hept-3-ene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
180.115029753 u |
| Formula |
C11H16O2 |
| InChI |
InChI=1S/C11H16O2/c1-7-4-5-11(3)6-9(10(7)11)13-8(2)12/h4,9-10H,5-6H2,1-3H3 |
| InChIKey |
OFEFROKNSLNBFH-UHFFFAOYSA-N |
| Molecular Weight |
180.247 g/mol |
| SMILES |
C12(C(C(C)=CC2)C(C1)OC(=O)C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.9789 |
![6-Acetoxy-1,4-dimethylbicyclo[3.2.0]hept-3-ene](/api/spectrum/2dCFQPd30RA/structure.png?h=300&w=458 "6-Acetoxy-1,4-dimethylbicyclo[3.2.0]hept-3-ene")
