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[3,6,8,3',5'-D5]-Apigenin 5 {5,7-Dihydroxy-2-(4-hydroxyphenyl-3,5-D2)-4H-1-benzopyran-4-one-3,6,8-D3}
SpectraBase Compound ID EqB0bhjFO9u
InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H/i3D,4D,5D,6D,7D
InChIKey KZNIFHPLKGYRTM-DKFMXDSJSA-N
Mol Weight 275.27 g/mol
Molecular Formula C15H5D5O5
Exact Mass 275.084207 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJZNX0bLq5L
Name [3,6,8,3',5'-D5]-Apigenin 5 {5,7-Dihydroxy-2-(4-hydroxyphenyl-3,5-D2)-4H-1-benzopyran-4-one-3,6,8-D3}
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Formula C15H5D5O5
InChI InChI=1S/C15H10O5/c16-9-3-1-8(2-4-9)13-7-12(19)15-11(18)5-10(17)6-14(15)20-13/h1-7,16-18H/i3D,4D,5D,6D,7D
InChIKey KZNIFHPLKGYRTM-DKFMXDSJSA-N
Molecular Weight 275.271 g/mol
SMILES Oc1c(cc(C=2Oc3c(c(c(c(c3[D])O)[D])O)C(C2[D])=O)cc1[D])[D]
SPLASH splash10-004i-0490000000-bf263bcd9f4f6986a56e
Source of Spectrum F-56-915-5
Synonyms 3,6,8-trideuterio-2-(3,5-dideuterio-4-hydroxyphenyl)-5,7-dihydroxy-1-benzopyran-4-one 3,6,8-trideuterio-2-(3,5-dideuterio-4-hydroxyphenyl)-5,7-dihydroxychromen-4-one 3,6,8-trideuterio-2-(3,5-dideuterio-4-hydroxy-phenyl)-5,7-dihydroxy-chromen-4-one 3,6,8-trideuterio-2-(3,5-dideuterio-4-oxidanyl-phenyl)-5,7-bis(oxidanyl)chromen-4-one
Wiley ID 855768