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KHYBLRUVCQCDOG-UGWCJAEPSA-N
SpectraBase Compound ID 7d0NOnxfJSv
InChI InChI=1S/C17H23Br3O4/c1-3-12(19)14-8-13(20)15(22-10(2)21)9-17-16(24-14)7-11(23-17)5-4-6-18/h5-6,11-17H,3,7-9H2,1-2H3/t4?,11-,12?,13+,14-,15-,16?,17?/m1/s1
InChIKey KHYBLRUVCQCDOG-UGWCJAEPSA-N
Mol Weight 531.08 g/mol
Molecular Formula C17H23Br3O4
Exact Mass 527.914648 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6VMWZ7DnsSC
Name KHYBLRUVCQCDOG-UGWCJAEPSA-N
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H23Br3O4
InChI InChI=1S/C17H23Br3O4/c1-3-12(19)14-8-13(20)15(22-10(2)21)9-17-16(24-14)7-11(23-17)5-4-6-18/h5-6,11-17H,3,7-9H2,1-2H3/t4?,11-,12?,13+,14-,15-,16?,17?/m1/s1
InChIKey KHYBLRUVCQCDOG-UGWCJAEPSA-N
Literature Reference Author A.D.WRIGHT,G.M.KOENIG,O.STICHER
Literature Reference Citation J.NAT.PROD.,54,1025(1991)
Literature Reference DOI 10.1021/np50076a016
Molecular Weight 531.079 g/mol
Solvent CDCl3
Source File Reference UWCS5274