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MAJOR_DIASTEREOMER
SpectraBase Compound ID I8dTOdAFLi7
InChI InChI=1S/C22H22Br4N10O2/c23-10-4-13(32-17(10)25)19(37)29-2-1-9(15-7-31-21(27)35-15)16-12(34-22(28)36-16)3-8-6-30-20(38-8)14-5-11(24)18(26)33-14/h4-5,7-9,32-33H,1-3,6H2,(H,29,37)(H3,27,31,35)(H3,28,34,36)
InChIKey PNXLSCCRBWDXON-UHFFFAOYSA-N
Mol Weight 778.1 g/mol
Molecular Formula C22H22Br4N10O2
Exact Mass 773.866072 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1SZSVHAXIwc
Name MINOR_DIASTEREOMER
Compound Number 16
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H22Br4N10O2
InChI InChI=1S/C22H22Br4N10O2/c23-10-4-13(32-17(10)25)19(37)29-2-1-9(15-7-31-21(27)35-15)16-12(34-22(28)36-16)3-8-6-30-20(38-8)14-5-11(24)18(26)33-14/h4-5,7-9,32-33H,1-3,6H2,(H,29,37)(H3,27,31,35)(H3,28,34,36)
InChIKey PNXLSCCRBWDXON-UHFFFAOYSA-N
Literature Reference Author C.LEJEUNE,H.TIAN,J.APPENSELLER,L.ERMOLENKO,M.T.MARTIN,A.AL-M OURABIT
Literature Reference Citation J.NAT.PROD.,76,903(2013)
Literature Reference DOI 10.1021/np400048r
Molecular Weight 778.098 g/mol
Sample ID 42512
Solvent DMF-D7