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Catalog | BBC104013618 |
CAS | 104013-61-8 |
Structure | ![]() |
Synonyms | 6(2H)-Benzofuranone, 2-(1,3-benzodioxol-5-yl)-3,3a-dihydro-3a-methoxy-3-methyl-5-(2-propen-1-yl)-, (2S,3R,3aS)- |
IUPAC Name | (2S,3R,3aS)-2-(1,3-benzodioxol-5-yl)-3a-methoxy-3-methyl-5-prop-2-enyl-2,3-dihydro-1-benzofuran-6-one |
Molecular Weight | 340.4 |
Molecular Formula | C20H20O5 |
Canonical SMILES | CC1C(OC2=CC(=O)C(=CC12OC)CC=C)C3=CC4=C(C=C3)OCO4 |
InChI | InChI=1S/C20H20O5/c1-4-5-14-10-20(22-3)12(2)19(25-18(20)9-15(14)21)13-6-7-16-17(8-13)24-11-23-16/h4,6-10,12,19H,1,5,11H2,2-3H3/t12-,19+,20+/m1/s1 |
InChI Key | GGRIWHJBFXFKGS-CFGAKRJMSA-N |
Purity | 98% |
Appearance | Powder |
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