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VENKATASIN
SpectraBase Compound ID Ag73YOrqss5
InChI InChI=1S/C22H20O9/c1-11(23)28-10-17-19(12-4-6-14(24)15(8-12)26-2)31-21-16(27-3)9-13-5-7-18(25)30-20(13)22(21)29-17/h4-9,17,19,24H,10H2,1-3H3/t17-,19-/m1/s1
InChIKey ICLAWMWLMZMRGC-IEBWSBKVSA-N
Mol Weight 428.39 g/mol
Molecular Formula C22H20O9
Exact Mass 428.110732 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G2NjoSNdJ4X
Name Durantin B
Alternate Name(s) [(2R,3R)-3-(4-hydroxy-3-methoxyphenyl)-5-methoxy-9-oxo-2,3-dihydro-9H-[1,4]dioxino[2,3-h]chromen-2-yl]methyl acetate
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Formula C22H20O9
InChI InChI=1S/C22H20O9/c1-11(23)28-10-17-19(12-4-6-14(24)15(8-12)26-2)31-21-16(27-3)9-13-5-7-18(25)30-20(13)22(21)29-17/h4-9,17,19,24H,10H2,1-3H3/t17-,19-/m1/s1
InChIKey ICLAWMWLMZMRGC-IEBWSBKVSA-N
Molecular Weight 428.393 g/mol
SMILES Oc1ccc([C@@]2([C@](Oc3c(O2)c(OC)cc2c3OC(=O)C=C2)(COC(=O)C)[H])[H])cc1OC
SPLASH splash10-0udu-0923000000-879297920476555be3e3
Source of Spectrum O1-60-156-2
Wiley ID 1591966