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APLYSFISTULARINE
SpectraBase Compound ID 9xFmYiNxvXa
InChI InChI=1S/C16H27Br2N2O/c1-19(2)8-6-10-21-16-14(17)11-13(12-15(16)18)7-9-20(3,4)5/h11-12H,6-10H2,1-5H3/q+1/p+1
InChIKey RKZMRKRFQSGNPA-UHFFFAOYSA-O
Mol Weight 424.22 g/mol
Molecular Formula C16H28Br2N2O
Exact Mass 422.05684 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LsNyElCVCvB
Name APLYSFISTULARINE;3,5-DIBROMO-4-[(3'-DIMETHYLAMONIUM)-PROPOXYPHENYL]-N,N,N-TRIMETHYLETHANAMONIUM
Compound Number 1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H28Br2N2O
InChI InChI=1S/C16H27Br2N2O/c1-19(2)8-6-10-21-16-14(17)11-13(12-15(16)18)7-9-20(3,4)5/h11-12H,6-10H2,1-5H3/q+1/p+1
InChIKey RKZMRKRFQSGNPA-UHFFFAOYSA-O
Literature Reference Author N.S.LIRA,R.L.MONTE-NETO,J.G.B.MARCHI,A.C.D.S.LINS,J.F.TAVARE S,M.S.D.SILVA
Literature Reference Citation QUIM.NOVA,35,2189(2012)
Literature Reference DOI 10.1590/s0100-40422012001100017
Molecular Weight 424.219 g/mol
Solvent CDCl3
Source File Reference UWIR12579