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5,7-Dihydroxy-4'-methoxyisoflavone
SpectraBase Compound ID DkeccAwFKzc
InChI InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,17-18H,1H3
InChIKey WUADCCWRTIWANL-UHFFFAOYSA-N
Mol Weight 284.27 g/mol
Molecular Formula C16H12O5
Exact Mass 284.068473 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 62eMbzIEbqa
Name 5,7-Dihydroxy-4'-methoxyisoflavone (Biochanin A)
CAS Registry Number 491-80-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12O5
InChI InChI=1S/C16H12O5/c1-20-11-4-2-9(3-5-11)12-8-21-14-7-10(17)6-13(18)15(14)16(12)19/h2-8,17-18H,1H3
InChIKey WUADCCWRTIWANL-UHFFFAOYSA-N
Molecular Weight 284.267 g/mol
SMILES Oc1cc(cc2OC=C(C(c12)=O)c1ccc(cc1)OC)O
SPLASH splash10-001i-1590000000-c838cf2b7f96976dbc17
Source of Spectrum E1-40-2973-3
Synonyms 5,7-Dihydroxy-3-(4-methoxyphenyl)-1-benzopyran-4-one 5,7-Dihydroxy-3-(4-methoxyphenyl)chromen-4-one 3-(4-Methoxyphenyl)-5,7-bis(oxidanyl)chromen-4-one
Wiley ID 1551711