| SpectraBase Spectrum ID |
KG13eJD39RU |
| Name |
Bicyclo[4.1.0]hept-2-ene-7-propanoic acid, 7-methyl-, ethyl ester, (1.alpha.,6.alpha.,7.alpha.)-(.+-.)- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
208.146329882 u |
| Formula |
C13H20O2 |
| InChI |
InChI=1S/C13H20O2/c1-3-15-12(14)8-9-13(2)10-6-4-5-7-11(10)13/h4,6,10-11H,3,5,7-9H2,1-2H3/t10-,11+,13+/m0/s1 |
| InChIKey |
SDXZACLLXIBEFW-DMDPSCGWSA-N |
| Molecular Weight |
208.301 g/mol |
| SMILES |
[C@@]1([C@]2(C=CCC[C@@]12[H])[H])(CCC(=O)OCC)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.982477 |
![Bicyclo[4.1.0]hept-2-ene-7-propanoic acid, 7-methyl-, ethyl ester, (1.alpha.,6.alpha.,7.alpha.)-(.+-.)-](/api/spectrum/KG13eJD39RU/structure.png?h=300&w=458 "Bicyclo[4.1.0]hept-2-ene-7-propanoic acid, 7-methyl-, ethyl ester, (1.alpha.,6.alpha.,7.alpha.)-(.+-.)-")
