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4H-1-Benzopyran-4-one-6,8-D2, 7-hydroxy-3-(4-hydroxyphenyl-3,5-D2)-
SpectraBase Compound ID ApYtOdlm4DV
InChI InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H/i3D,4D,5D,7D
InChIKey ZQSIJRDFPHDXIC-GDUMDNCPSA-N
Mol Weight 258.27 g/mol
Molecular Formula C15H62D4O4
Exact Mass 258.083016 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6fWgMnV4MeJ
Name 4H-1-Benzopyran-4-one-6,8-D2, 7-hydroxy-3-(4-hydroxyphenyl-3,5-D2)-
CAS Registry Number 104411-13-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H6D4O4
InChI InChI=1S/C15H10O4/c16-10-3-1-9(2-4-10)13-8-19-14-7-11(17)5-6-12(14)15(13)18/h1-8,16-17H/i3D,4D,5D,7D
InChIKey ZQSIJRDFPHDXIC-GDUMDNCPSA-N
Molecular Weight 258.265 g/mol
SMILES Oc1c(cc2C(C(c3cc(c(c(c3)[2D])O)[2D])=COc2c1[2D])=O)[2D]
SPLASH splash10-0079-1910000000-058aaeb7e2467e4ebc30
Source of Spectrum KC-1986-97-5
Synonyms 6,8,3',5'-Tetradeuterio-3-(4'-hydroxyphenyl)-7-hydroxybenzopyran-4-one [6,8,3',5'-D(4)]daidzein
Wiley ID 1257838