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(E)-6-BROMO-4'-DEMETHYL-3'-N-METHYL-APLYSINOPSIN
SpectraBase Compound ID 4bJXYHgSAfO
InChI InChI=1S/C14H13BrN4O/c1-16-14-18-13(20)12(19(14)2)5-8-7-17-11-6-9(15)3-4-10(8)11/h3-7,17H,1-2H3,(H,16,18,20)/b12-5+
InChIKey LKVQIMAPGZMTJI-LFYBBSHMSA-N
Mol Weight 333.19 g/mol
Molecular Formula C14H13BrN4O
Exact Mass 332.027274 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HX6uc0aPTgy
Name (E)-6-BROMO-4'-DEMETHYL-3'-N-METHYL-APLYSINOPSIN
Compound Number 43
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H13BrN4O
InChI InChI=1S/C14H13BrN4O/c1-16-14-18-13(20)12(19(14)2)5-8-7-17-11-6-9(15)3-4-10(8)11/h3-7,17H,1-2H3,(H,16,18,20)/b12-5+
InChIKey LKVQIMAPGZMTJI-LFYBBSHMSA-N
Literature Reference Author P.M.PAULETTI,L.S.CINTRA,C.G.BRAGUINE,A.A.D.S.FILHO,M.L.A.E.S ILVA,W.R.CUNHA
Literature Reference Citation MAR.DRUGS,8,1526(2010)
Literature Reference DOI 10.3390/md8051526
Molecular Weight 333.187 g/mol
Source File Reference UWIR6240