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1-(4-aminophenyl)-2-(4-chlorophenyl)-3,3-dimethylcyclopropane-trans-1,2-diyl diacetate
SpectraBase Compound ID H5msKgPWrR8
InChI InChI=1S/C21H22ClNO4/c1-13(24)26-20(15-5-9-17(22)10-6-15)19(3,4)21(20,27-14(2)25)16-7-11-18(23)12-8-16/h5-12H,23H2,1-4H3/t20-,21-/m0/s1
InChIKey LQVPHXYOTZHQIJ-SFTDATJTSA-N
Mol Weight 387.86 g/mol
Molecular Formula C21H22ClNO4
Exact Mass 387.123736 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9G57nB6bHCZ
Name 1-(4-AMINOPHENYL)-2-(4-CHLOROPHENYL)-3,3-DIMETHYLCYClOPROPANE-TRANS-1,2-DIYL-DIACETATE
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22ClNO4
InChI InChI=1S/C21H22ClNO4/c1-13(24)26-20(15-5-9-17(22)10-6-15)19(3,4)21(20,27-14(2)25)16-7-11-18(23)12-8-16/h5-12H,23H2,1-4H3/t20-,21-/m0/s1
InChIKey LQVPHXYOTZHQIJ-SFTDATJTSA-N
Literature Reference Author B.R.DAVIS,M.G.HINDS
Literature Reference Citation AUSTR.J.CHEM.,50,309(1997)
Literature Reference DOI 10.1071/C96107
Molecular Weight 387.863 g/mol
Solvent CDCl3
Source File Reference UWCS15558