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3-BROMO-12-(R/S)-ETHENYL-6,11-DIHYDRO-8,10-DIMETHOXY-5-(R/S),11-METHANO-5H-BENZO-[5.6]-CYCLOHEPTA-[1,2-B]-PYRIDIN-11-(S/R)-AMINE

View entire compound with spectra: 1 NMR

3-BROMO-12-(R/S)-ETHENYL-6,11-DIHYDRO-8,10-DIMETHOXY-5-(R/S),11-METHANO-5H-BENZO-[5.6]-CYCLOHEPTA-[1,2-B]-PYRIDIN-11-(S/R)-AMINE
SpectraBase Compound ID JXu0kLMiUbK
InChI InChI=1S/C19H19BrN2O2/c1-4-15-13-6-10-5-12(23-2)8-16(24-3)17(10)19(15,21)18-14(13)7-11(20)9-22-18/h4-5,7-9,13,15H,1,6,21H2,2-3H3/t13-,15?,19?/m1/s1
InChIKey ZZRMHACTPXYFDS-VZDIAYEVSA-N
Mol Weight 387.28 g/mol
Molecular Formula C19H19BrN2O2
Exact Mass 386.062991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3sKe8OQDT9D
Name 3-BROMO-12-(R/S)-ETHENYL-6,11-DIHYDRO-8,10-DIMETHOXY-5-(R/S),11-METHANO-5H-BENZO-[5.6]-CYCLOHEPTA-[1,2-B]-PYRIDIN-11-(S/R)-AMINE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H19BrN2O2
InChI InChI=1S/C19H19BrN2O2/c1-4-15-13-6-10-5-12(23-2)8-16(24-3)17(10)19(15,21)18-14(13)7-11(20)9-22-18/h4-5,7-9,13,15H,1,6,21H2,2-3H3/t13-,15?,19?/m1/s1
InChIKey ZZRMHACTPXYFDS-VZDIAYEVSA-N
Literature Reference Author J.KELLY,M.S.PUAR,A.AFONSO,A.T.M.PHAIL
Literature Reference Citation J.ORG.CHEM.,63,6039(1998)
Literature Reference DOI 10.1021/jo9803378
Molecular Weight 387.276 g/mol
Sample ID 28644
Solvent CDCl3