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(2R,3R)-2-(4-hydroxy-3-methoxy-phenyl)-5-[(E)-3-keto-3-methoxy-prop-1-enyl]-7-methoxy-coumaran-3-carboxylic acid methyl ester
SpectraBase Compound ID ETVGp82PvKp
InChI InChI=1S/C22H22O8/c1-26-16-11-13(6-7-15(16)23)20-19(22(25)29-4)14-9-12(5-8-18(24)28-3)10-17(27-2)21(14)30-20/h5-11,19-20,23H,1-4H3/b8-5+/t19-,20+/m1/s1
InChIKey TUMXSJCAHHPAFR-ZLNADXECSA-N
Mol Weight 414.41 g/mol
Molecular Formula C22H22O8
Exact Mass 414.131468 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FfvoqbSbCRW
Name (2R,3R)-2-(4-hydroxy-3-methoxy-phenyl)-5-[(E)-3-keto-3-methoxy-prop-1-enyl]-7-methoxy-coumaran-3-carboxylic acid methyl ester
Alternate Name(s) (2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-5-[(E)-3-methoxy-3-oxoprop-1-enyl]-2,3-dihydrobenzofuran-3-carboxylic acid methyl ester Methyl (2R,3R)-2-(4-hydroxy-3-methoxy-phenyl)-7-methoxy-5-[(E)-3-methoxy-3-oxo-prop-1-enyl]-2,3-dihydrobenzofuran-3-carboxylate Methyl (2R,3R)-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-5-[(E)-3-methoxy-3-oxoprop-1-enyl]-2,3-dihydro-1-benzofuran-3-carboxylate Methyl (2R,3R)-7-methoxy-5-[(E)-3-methoxy-3-oxidanylidene-prop-1-enyl]-2-(3-methoxy-4-oxidanyl-phenyl)-2,3-dihydro-1-benzofuran-3-carboxylate
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Formula C22H22O8
InChI InChI=1S/C22H22O8/c1-26-16-11-13(6-7-15(16)23)20-19(22(25)29-4)14-9-12(5-8-18(24)28-3)10-17(27-2)21(14)30-20/h5-11,19-20,23H,1-4H3/b8-5+/t19-,20+/m1/s1
InChIKey TUMXSJCAHHPAFR-ZLNADXECSA-N
Molecular Weight 414.410 g/mol
SMILES Oc1ccc([C@]2([C@@](c3c(c(OC)cc(\C=C\C(=O)OC)c3)O2)(C(=O)OC)[H])[H])cc1OC
SPLASH splash10-0il0-0009700000-1358b988f4fed187d0a0
Source of Spectrum G4-59-625-3
Wiley ID 1606388