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14-BrOMO-3-DIHYDRO-7,8-DEHYDRODISCORHABDIN_C
SpectraBase Compound ID E5Jdkfz4fdQ
InChI InChI=1S/C18H12Br3N3O2/c19-8-5-18(6-9(20)15(8)25)2-4-23-14-11(18)12-10-7(1-3-22-12)17(21)24-13(10)16(14)26/h2,4-6,15,23-25H,1,3H2/p+1
InChIKey VCBOKXIVCCHFSL-UHFFFAOYSA-O
Mol Weight 543.03 g/mol
Molecular Formula C18H13Br3N3O2
Exact Mass 539.855791 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DmI013N40Dh
Name 14-BrOMO-3-DIHYDRO-7,8-DEHYDRODISCORHABDIN_C
Compound Number 5
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H13Br3N3O2
InChI InChI=1S/C18H12Br3N3O2/c19-8-5-18(6-9(20)15(8)25)2-4-23-14-11(18)12-10-7(1-3-22-12)17(21)24-13(10)16(14)26/h2,4-6,15,23-25H,1,3H2/p+1
InChIKey VCBOKXIVCCHFSL-UHFFFAOYSA-O
Literature Reference Author E.M.ANTUNES,D.R.BEUKES,M.KELLY,T.SAMAAI,L.R.BARROWS,K.M.MARS HALL,C.SINCICH,M.T.D
Literature Reference Citation J.NAT.PROD.,67,1268(2004)
Literature Reference DOI 10.1021/np034084b
Molecular Weight 543.032 g/mol
Solvent DMSO-D6
Source File Reference UWMZ7306