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ETHYL-(2S,3S)-3-CYCLOHEXYL-3-(3,5-DINITROBENZOYLOXY)-2-METHYLPROPANOATE
SpectraBase Compound ID E4ntCOx7BEO
InChI InChI=1S/C19H24N2O8/c1-3-28-18(22)12(2)17(13-7-5-4-6-8-13)29-19(23)14-9-15(20(24)25)11-16(10-14)21(26)27/h9-13,17H,3-8H2,1-2H3/t12-,17-/m1/s1
InChIKey ZHCAIDZYSUGWSY-SJKOYZFVSA-N
Mol Weight 408.41 g/mol
Molecular Formula C19H24N2O8
Exact Mass 408.153266 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2aEW45bvO3K
Name ETHYL-(2S,3S)-3-CYCLOHEXYL-3-(3,5-DINITROBENZOYLOXY)-2-METHYLPROPANOATE
Compound Number 9
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H24N2O8
InChI InChI=1S/C19H24N2O8/c1-3-28-18(22)12(2)17(13-7-5-4-6-8-13)29-19(23)14-9-15(20(24)25)11-16(10-14)21(26)27/h9-13,17H,3-8H2,1-2H3/t12-,17-/m1/s1
InChIKey ZHCAIDZYSUGWSY-SJKOYZFVSA-N
Literature Reference Author S.E.DANMARK,T.WYNN,G.L.BEUTNER
Literature Reference Citation J.AM.CHEM.SOC.,124,13405(2002)
Literature Reference DOI 10.1021/ja0282947
Molecular Weight 408.408 g/mol
Sample ID 47826
Solvent CDCl3