| SpectraBase Spectrum ID |
EU8uIURlFtx |
| Name |
Ethyl (1'rs,5'sr)-(3',3'-dimethyl-2',4'dioxabicyclo[3.3.0]oct-6'-enyl)acetate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
226.120509056 u |
| Formula |
C12H18O4 |
| InChI |
InChI=1S/C12H18O4/c1-4-14-10(13)7-8-5-6-9-11(8)16-12(2,3)15-9/h5,9,11H,4,6-7H2,1-3H3 |
| InChIKey |
DIOYIZNRTKKUFB-UHFFFAOYSA-N |
| Molecular Weight |
226.272 g/mol |
| SMILES |
C=1(C2OC(C)(C)OC2CC1)CC(=O)OCC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.817135 |
![Ethyl (1'rs,5'sr)-(3',3'-dimethyl-2',4'dioxabicyclo[3.3.0]oct-6'-enyl)acetate](/api/spectrum/EU8uIURlFtx/structure.png?h=300&w=458 "Ethyl (1'rs,5'sr)-(3',3'-dimethyl-2',4'dioxabicyclo[3.3.0]oct-6'-enyl)acetate")
