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4-NITRO-1-[2'-(3''-PHENYLPROP-1''-YNYL)-CYCLOHEX-1'-EN-1'-YL]-PENTAN-1-ONE
SpectraBase Compound ID D7lSF81ndFz
InChI InChI=1S/C20H23NO3/c1-16(21(23)24)14-15-20(22)19-13-6-5-11-18(19)12-7-10-17-8-3-2-4-9-17/h2-4,8-9,16H,5-6,10-11,13-15H2,1H3
InChIKey BJUIYKSHHGNAIT-UHFFFAOYSA-N
Mol Weight 325.41 g/mol
Molecular Formula C20H23NO3
Exact Mass 325.167794 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9ORkog3PDCG
Name 4-NITRO-1-[2'-(3''-PHENYLPROP-1''-YNYL)-CYCLOHEX-1'-EN-1'-YL]-PENTAN-1-ONE
Compound Number 31B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H23NO3
InChI InChI=1S/C20H23NO3/c1-16(21(23)24)14-15-20(22)19-13-6-5-11-18(19)12-7-10-17-8-3-2-4-9-17/h2-4,8-9,16H,5-6,10-11,13-15H2,1H3
InChIKey BJUIYKSHHGNAIT-UHFFFAOYSA-N
Literature Reference Author K.KNOBLOCH,J.KOCH,M.KELLER,W.EBERBACH
Literature Reference Citation EUR.J.ORG.CHEM.,2715(2005)
Molecular Weight 325.408 g/mol
Sample ID 29535
Solvent CDCl3