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ETHYL-2-CARBETHOXY-3-(2,4-DICHLOROPHENYL)-4-(3-METHYL-4-NITROISOXAZOL-5-YL)-BUTYRATE
SpectraBase Compound ID IgSucQxiIuf
InChI InChI=1S/C19H20Cl2N2O7/c1-4-28-18(24)16(19(25)29-5-2)13(12-7-6-11(20)8-14(12)21)9-15-17(23(26)27)10(3)22-30-15/h6-8,13,16H,4-5,9H2,1-3H3
InChIKey ZRZFBDFGAXHJKE-UHFFFAOYSA-N
Mol Weight 459.28 g/mol
Molecular Formula C19H20Cl2N2O7
Exact Mass 458.064756 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1Ihk4vAEo6Q
Name ETHYL-2-CARBETHOXY-3-(2,4-DICHLOROPHENYL)-4-(3-METHYL-4-NITROISOXAZOL-5-YL)-BUTYRATE
Compound Number 2E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H20Cl2N2O7
InChI InChI=1S/C19H20Cl2N2O7/c1-4-28-18(24)16(19(25)29-5-2)13(12-7-6-11(20)8-14(12)21)9-15-17(23(26)27)10(3)22-30-15/h6-8,13,16H,4-5,9H2,1-3H3
InChIKey ZRZFBDFGAXHJKE-UHFFFAOYSA-N
Literature Reference Author A.BARACCHI,S.CHIMICHI,F.DESIO,D.DONATI,C.POLO,P.SARTI-FANTON I
Literature Reference Citation HETEROCYCLES,31,1823(1990)
Literature Reference DOI 10.3987/COM-90-5507
Molecular Weight 459.283 g/mol
Solvent CDCl3
Source File Reference UWCP2682