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DIOFLORIN
SpectraBase Compound ID KWKymAg50Bo
InChI InChI=1S/C21H22O6/c1-11(2)8-9-13-18(24)17-15(23)10-16(12-6-4-5-7-14(12)22)27-20(17)21(26-3)19(13)25/h4-8,16,22,24-25H,9-10H2,1-3H3/t16-/m1/s1
InChIKey DWICVFARTYFNMY-MRXNPFEDSA-N
Mol Weight 370.4 g/mol
Molecular Formula C21H22O6
Exact Mass 370.141638 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2odRhPouaA
Name (2R)-2-(2-hydroxyphenyl)-8-methoxy-6-(3-methylbut-2-enyl)-5,7-bis(oxidanyl)-2,3-dihydrochromen-4-one
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Formula C21H22O6
InChI InChI=1S/C21H22O6/c1-11(2)8-9-13-18(24)17-15(23)10-16(12-6-4-5-7-14(12)22)27-20(17)21(26-3)19(13)25/h4-8,16,22,24-25H,9-10H2,1-3H3/t16-/m1/s1
InChIKey DWICVFARTYFNMY-MRXNPFEDSA-N
Molecular Weight 370.401 g/mol
SMILES Oc1c([C@@]2(Oc3c(c(c(c(c3OC)O)CC=C(C)C)O)C(C2)=O)[H])cccc1
SPLASH splash10-05tf-4129000000-6c1797b5b55dcd9313c1
Source of Spectrum G4-61-413-1
Synonyms (2R)-5,7-dihydroxy-2-(2-hydroxyphenyl)-8-methoxy-6-(3-methylbut-2-enyl)-2,3-dihydrochromen-4-one (2R)-5,7-dihydroxy-2-(2-hydroxyphenyl)-8-methoxy-6-(3-methylbut-2-enyl)-3,4-dihydro-2H-1-benzopyran-4-one (2R)-5,7-dihydroxy-2-(2-hydroxyphenyl)-8-methoxy-6-(3-methylbut-2-enyl)chroman-4-one Dioflorin
Wiley ID 1607129