SpectraBase Spectrum ID |
Ll0i9DIMbz8 |
Name |
3,4-Dihydroxy-10-oxo-2-propyl-2,3,4,7,8,9-hexahydrooxecin-9-yl hexa-2,4-dienoate, o,o-diacetyl |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
422.194067918 u |
Formula |
C22H30O8 |
InChI |
InChI=1S/C22H30O8/c1-5-7-8-14-20(25)29-19-13-10-9-12-18(27-15(3)23)21(28-16(4)24)17(11-6-2)30-22(19)26/h5,7-9,12,14,17-19,21H,6,10-11,13H2,1-4H3/b7-5+,12-9+,14-8+ |
InChIKey |
YIEDBQBSGKLDQQ-KRKAYDLTSA-N |
Molecular Weight |
422.474 g/mol |
SMILES |
C1(OC(=O)C)C(OC(C)=O)\C=C\CCC(C(=O)OC1CCC)OC(\C=C\C=C\C)=O |