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3,5-Dihydroxy-6',6'-dimethyl-2H-pyrano[2',3' : 6,7]-6'',6''-DIMETHYL2H,4H-pyrano[2'',3'' : 1,2]-xanthone
SpectraBase Compound ID 9bZDOAOCew9
InChI InChI=1S/C23H22O6/c1-22(2)7-5-11-9-13-17(25)16-15(27-21(13)18(26)19(11)28-22)10-14(24)12-6-8-23(3,4)29-20(12)16/h5,7,9-10,24,26H,6,8H2,1-4H3
InChIKey CBXJCUQUZYEDHE-UHFFFAOYSA-N
Mol Weight 394.42 g/mol
Molecular Formula C23H22O6
Exact Mass 394.141638 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7ugiTxbfCZC
Name 3,5-Dihydroxy-6',6'-dimethyl-2H-pyrano[2',3' : 6,7]-6'',6''-DIMETHYL2H,4H-pyrano[2'',3'' : 1,2]-xanthone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 394.141638422 u
Formula C23H22O6
InChI InChI=1S/C23H22O6/c1-22(2)7-5-11-9-13-17(25)16-15(27-21(13)18(26)19(11)28-22)10-14(24)12-6-8-23(3,4)29-20(12)16/h5,7,9-10,24,26H,6,8H2,1-4H3
InChIKey CBXJCUQUZYEDHE-UHFFFAOYSA-N
Molecular Weight 394.423 g/mol
SMILES C1=2C(C3=CC=4C=CC(OC4C(=C3OC2C=C(O)C2=C1OC(CC2)(C)C)O)(C)C)=O