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CALEDONIXANTHONE-L
SpectraBase Compound ID H0ttTKbZLct
InChI InChI=1S/C23H22O8/c1-22(2)6-5-9-12(30-22)8-13-14(15(9)24)16(25)10-7-11-17(26)21(28)23(3,4)31-20(11)18(27)19(10)29-13/h5-8,17,21,24,26-28H,1-4H3/t17-,21-/m1/s1
InChIKey BWECSBFMOODIDP-DYESRHJHSA-N
Mol Weight 426.42 g/mol
Molecular Formula C23H22O8
Exact Mass 426.131468 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BLmrLQQ1eI4
Name CALEDONIXANTHONE-L
Compound Number 13
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C23H22O8
InChI InChI=1S/C23H22O8/c1-22(2)6-5-9-12(30-22)8-13-14(15(9)24)16(25)10-7-11-17(26)21(28)23(3,4)31-20(11)18(27)19(10)29-13/h5-8,17,21,24,26-28H,1-4H3/t17-,21-/m1/s1
InChIKey BWECSBFMOODIDP-DYESRHJHSA-N
Literature Reference Author C.MOREL,A.E.HAY,M.LITAUDON,T.SEVENET,D.SERAPHIN,J.BRUNETON,P .RICHOMME
Literature Reference Citation MOLECULES,7,38(2002)
Literature Reference DOI 10.3390/70100038
Molecular Weight 426.423 g/mol
Solvent CD3OD
Source File Reference UWLU7662