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savinin Structure

savinin

Chemical Properties

Melting point 146.4-148.4 °C(Solv: benzene (71-43-2))
Boiling point 573.5±39.0 °C(Predicted)
Density  1.439±0.06 g/cm3(Predicted)
InChI InChI=1S/C20H16O6/c21-20-15(6-13-2-4-17-19(8-13)26-11-24-17)14(9-22-20)5-12-1-3-16-18(7-12)25-10-23-16/h1-4,6-8,14H,5,9-11H2/b15-6+/t14-/m0/s1
InChIKey CMJGAYUQSLJSCR-ULIPXBITSA-N
SMILES O1C[C@H](CC2=CC=C3OCOC3=C2)/C(=C\C2=CC=C3OCOC3=C2)/C1=O

Usage And Synthesis

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