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(+/-)-TRANS-4-ACETOXY-3-BROMO-3,4-DIHYDRO-5,10-DIMETHOXY-2,2-DIMETHYL-2H,6H-PYRAN-[3,2-B]-XANTHEN-6-ONE
SpectraBase Compound ID LtuuJBaq18S
InChI InChI=1S/C22H21BrO7/c1-10(24)28-20-16-14(30-22(2,3)21(20)23)9-13-15(19(16)27-5)17(25)11-7-6-8-12(26-4)18(11)29-13/h6-9,20-21H,1-5H3/t20-,21+/m1/s1
InChIKey OZJBHGRAHZZENZ-RTWAWAEBSA-N
Mol Weight 477.31 g/mol
Molecular Formula C22H21BrO7
Exact Mass 476.047066 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5bppgYC9a83
Name (+/-)-TRANS-4-ACETOXY-3-BROMO-3,4-DIHYDRO-5,10-DIMETHOXY-2,2-DIMETHYL-2H,6H-PYRAN-[3,2-B]-XANTHEN-6-ONE
Compound Number 4AD
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H21BrO7
InChI InChI=1S/C22H21BrO7/c1-10(24)28-20-16-14(30-22(2,3)21(20)23)9-13-15(19(16)27-5)17(25)11-7-6-8-12(26-4)18(11)29-13/h6-9,20-21H,1-5H3/t20-,21+/m1/s1
InChIKey OZJBHGRAHZZENZ-RTWAWAEBSA-N
Literature Reference Author P.MARAKOS,A.L.SKALTSOUNIS,S.LEONCE,G.ATASSI,D.H.CAIGNARD,K.G HIRTIS,N.POULI
Literature Reference Citation J.HETCYCL.CHEM.,38,147(2001)
Literature Reference DOI 10.1002/jhet.5570380121
Molecular Weight 477.309 g/mol
Solvent CDCl3
Source File Reference UWLU20970