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Irisoid B [1,8-dihydroxy-9,10-dimethoxy-[1]benzopyrano[3,2-c][2]benzopyran-7(5H)-one]
SpectraBase Compound ID 7Qw2h43Gvpw
InChI InChI=1S/C18H14O7/c1-22-11-6-10-13(14(20)16(11)23-2)15(21)18-17(25-10)12-8(7-24-18)4-3-5-9(12)19/h3-6,19-20H,7H2,1-2H3
InChIKey QVHFICYAHDSZBK-UHFFFAOYSA-N
Mol Weight 342.3 g/mol
Molecular Formula C18H14O7
Exact Mass 342.073953 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID tulIJ5jDlU
Name Irisoid B [1,8-dihydroxy-9,10-dimethoxy-[1]benzopyrano[3,2-c][2]benzopyran-7(5H)-one]
Alternate Name(s) 1,8-Dihydroxy-9,10-dimethoxy[2]benzopyrano[4,3-b]chromen-7(5H)-one 1,8-Dihydroxy-9,10-dimethoxy-5H-[2]benzopyrano[4,3-b][1]benzopyran-7-one 9,10-dimethoxy-1,8-bis(oxidanyl)-5H-isochromeno[4,3-b]chromen-7-one
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Formula C18H14O7
InChI InChI=1S/C18H14O7/c1-22-11-6-10-13(14(20)16(11)23-2)15(21)18-17(25-10)12-8(7-24-18)4-3-5-9(12)19/h3-6,19-20H,7H2,1-2H3
InChIKey QVHFICYAHDSZBK-UHFFFAOYSA-N
Molecular Weight 342.303 g/mol
SMILES Oc1c(c(cc2c1C(C1=C(c3c(cccc3CO1)O)O2)=O)OC)OC
SPLASH splash10-0005-0539000000-5b84af2262ac4ddeba65
Source of Spectrum E2-49-1298-2
Wiley ID 1555720