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2-BROMO-8-CYANO-6H,12H-5,11-METHANODIBENZO-[B,F]-[1,5]-DIAZOCINE
SpectraBase Compound ID 1aaZqxVrVdV
InChI InChI=1S/C16H12BrN3/c17-14-2-4-16-13(6-14)9-20-10-19(16)8-12-5-11(7-18)1-3-15(12)20/h1-6H,8-10H2
InChIKey WCNPRZLNRNGFGX-UHFFFAOYSA-N
Mol Weight 326.2 g/mol
Molecular Formula C16H12BrN3
Exact Mass 325.02146 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HX896bKjJLw
Name 2-BROMO-8-CYANO-6H,12H-5,11-METHANODIBENZO-[B,F]-[1,5]-DIAZOCINE
Compound Number 6G
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H12BrN3
InChI InChI=1S/C16H12BrN3/c17-14-2-4-16-13(6-14)9-20-10-19(16)8-12-5-11(7-18)1-3-15(12)20/h1-6H,8-10H2
InChIKey WCNPRZLNRNGFGX-UHFFFAOYSA-N
Literature Reference Author J.JENSEN,J.TEJLER,K.WAERNMARK
Literature Reference Citation J.ORG.CHEM.,67,6008(2002)
Literature Reference DOI 10.1021/jo025823g
Molecular Weight 326.195 g/mol
Solvent CDCl3
Source File Reference UWMS25432