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1,3-BIS-[(2-BROMOETHYL)-TETRAZOL-5-YL]-BENZENE(1-N,2-N')

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1,3-BIS-[(2-BROMOETHYL)-TETRAZOL-5-YL]-BENZENE(1-N,2-N')
SpectraBase Compound ID FxgseKOJrBH
InChI InChI=1S/C12H12Br2N8/c13-4-6-21-12(16-18-20-21)10-3-1-2-9(8-10)11-15-19-22(17-11)7-5-14/h1-3,8H,4-7H2
InChIKey JMAONCPTPPULRN-UHFFFAOYSA-N
Mol Weight 428.09 g/mol
Molecular Formula C12H12Br2N8
Exact Mass 425.955168 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EOUMyJynNDa
Name 1,3-BIS-[(2-BROMOETHYL)-TETRAZOL-5-YL]-BENZENE(1-N,2-N')
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12Br2N8
InChI InChI=1S/C12H12Br2N8/c13-4-6-21-12(16-18-20-21)10-3-1-2-9(8-10)11-15-19-22(17-11)7-5-14/h1-3,8H,4-7H2
InChIKey JMAONCPTPPULRN-UHFFFAOYSA-N
Literature Reference Author P.A.BETHEL,M.S.HILL,M.F.MAHON,K.C.MOLLOY
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3507(1999)
Literature Reference DOI 10.1039/a905336k
Molecular Weight 428.089 g/mol
Solvent CDCl3