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(3ASR,7ARS)-5,6-DIMETHYL-3A-NITRO-3-PHENYL-3A,4,7,7A-TETRAHYDRO-1,2-BENZISOXAZOLE-7A-CARBOXYLATE
SpectraBase Compound ID GiWCv8uc6j5
InChI InChI=1S/C18H20N2O5/c1-4-24-16(21)18-11-13(3)12(2)10-17(18,20(22)23)15(19-25-18)14-8-6-5-7-9-14/h5-9H,4,10-11H2,1-3H3/t17-,18-/m1/s1
InChIKey YNWCOENYCAOMII-QZTJIDSGSA-N
Mol Weight 344.37 g/mol
Molecular Formula C18H20N2O5
Exact Mass 344.137222 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KnISzZHT4N8
Name (3ASR,7ARS)-5,6-DIMETHYL-3A-NITRO-3-PHENYL-3A,4,7,7A-TETRAHYDRO-1,2-BENZISOXAZOLE-7A-CARBOXYLATE
CAS Registry Number 124286-99-3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H20N2O5
InChI InChI=1S/C18H20N2O5/c1-4-24-16(21)18-11-13(3)12(2)10-17(18,20(22)23)15(19-25-18)14-8-6-5-7-9-14/h5-9H,4,10-11H2,1-3H3/t17-,18-/m1/s1
InChIKey YNWCOENYCAOMII-QZTJIDSGSA-N
Literature Reference Author R.NESI,D.GIOMI,S.PAPALEO,M.CORTI
Literature Reference Citation J.ORG.CHEM.,55,1227(1990)
Literature Reference DOI 10.1021/jo00291a023
Molecular Weight 344.367 g/mol
Solvent CDCl3
Source File Reference UWED9955