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(2R,3R,11BS/2S,3S,11BR)-2-BROMOMETHYL-3-ETHYL-1,2,3,6,7,11B-HEXAHYDRO-4H-BENZO-[A]-QUINOLIZIN-4-ONE
SpectraBase Compound ID IrKoBQPGjJP
InChI InChI=1S/C16H20BrNO/c1-2-13-12(10-17)9-15-14-6-4-3-5-11(14)7-8-18(15)16(13)19/h3-6,12-13,15H,2,7-10H2,1H3/t12-,13+,15-/m0/s1
InChIKey SQKXLNXTTTYUEB-GUTXKFCHSA-N
Mol Weight 322.25 g/mol
Molecular Formula C16H20BrNO
Exact Mass 321.072827 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3dYaHqsWUxA
Name (2R,3R,11BS/2S,3S,11BR)-2-BROMOMETHYL-3-ETHYL-1,2,3,6,7,11B-HEXAHYDRO-4H-BENZO-[A]-QUINOLIZIN-4-ONE
Compound Number 7
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H20BrNO
InChI InChI=1S/C16H20BrNO/c1-2-13-12(10-17)9-15-14-6-4-3-5-11(14)7-8-18(15)16(13)19/h3-6,12-13,15H,2,7-10H2,1H3/t12-,13+,15-/m0/s1
InChIKey SQKXLNXTTTYUEB-GUTXKFCHSA-N
Literature Reference Author E.REIMANN,M.RENZ
Literature Reference Citation MH.CHEM.,138,211(2007)
Literature Reference DOI 10.1007/s00706-007-0601-x
Molecular Weight 322.245 g/mol
Sample ID 68537
Solvent CDCl3