| SpectraBase Spectrum ID |
29EnZMOuK94 |
| Name |
Ethyl hexahydro-2,5,5,8-tetramethyl-7-oxo-2H,5H-pyrano[4,3-B]pyran-3-carboxylate |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.162373868 u |
| Formula |
C15H24O5 |
| InChI |
InChI=1S/C15H24O5/c1-6-18-14(17)10-7-11-12(19-9(10)3)8(2)13(16)20-15(11,4)5/h8-12H,6-7H2,1-5H3 |
| InChIKey |
FZXSXBALYLNDDD-UHFFFAOYSA-N |
| SMILES |
C12C(CC(C(O2)C)C(=O)OCC)C(OC(C1C)=O)(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.967892 |
![Ethyl hexahydro-2,5,5,8-tetramethyl-7-oxo-2H,5H-pyrano[4,3-b]pyran-3-carboxylate](/api/spectrum/29EnZMOuK94/structure.png?h=300&w=458 "Ethyl hexahydro-2,5,5,8-tetramethyl-7-oxo-2H,5H-pyrano[4,3-b]pyran-3-carboxylate")
