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1-DEOXO-1-CHLOROHUPERZINONE
SpectraBase Compound ID IBp1i1nX36g
InChI InChI=1S/C17H21ClN2/c1-5-13-12-8-11(2)10-17(13,20(3)4)14-6-7-16(18)19-15(14)9-12/h5-8,12-13H,1,9-10H2,2-4H3/t12-,13+,17+/m0/s1
InChIKey QYMWDGVSRSEZKZ-OGHNNQOOSA-N
Mol Weight 288.82 g/mol
Molecular Formula C17H21ClN2
Exact Mass 288.139326 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9phd4fcMWdM
Name 1-DEOXO-1-CHLOROHUPERZINONE
Compound Number 14A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H21ClN2
InChI InChI=1S/C17H21ClN2/c1-5-13-12-8-11(2)10-17(13,20(3)4)14-6-7-16(18)19-15(14)9-12/h5-8,12-13H,1,9-10H2,2-4H3/t12-,13+,17+/m0/s1
InChIKey QYMWDGVSRSEZKZ-OGHNNQOOSA-N
Literature Reference Author Y.TANG,Y.FU,J.XIONG,M.LI,G.L.MA,G.X.YANG,B.G.WEI,Y.ZHAO,H.Y. ZHANG,J.F.HU
Literature Reference Citation J.NAT.PROD.,76,1475(2013)
Literature Reference DOI 10.1021/np4003355
Molecular Weight 288.820 g/mol
Solvent CDCl3
Source File Reference UWMZ43052