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3-ETHOXYCARBONYL-7-NITRO-5A-PHENYL-1,3,3A,4,5,9B-HEXAHYDROISOXAZOLO-[4,3-C]-QUINOLIN-2-ONE
SpectraBase Compound ID INoLL8yCkio
InChI InChI=1S/C19H17N3O6/c1-2-27-18(24)16-15-17(23)20-14-9-8-12(22(25)26)10-13(14)19(15,21-28-16)11-6-4-3-5-7-11/h3-10,15-16,21H,2H2,1H3,(H,20,23)/t15-,16-,19?/m1/s1
InChIKey VUSXOGCIEAXHPW-QNRNLVPOSA-N
Mol Weight 383.36 g/mol
Molecular Formula C19H17N3O6
Exact Mass 383.111735 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4ltZjrtMAp8
Name 3-ETHOXYCARBONYL-7-NITRO-5A-PHENYL-1,3,3A,4,5,9B-HEXAHYDROISOXAZOLO-[4,3-C]-QUINOLIN-2-ONE
Compound Number 5H
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H17N3O6
InChI InChI=1S/C19H17N3O6/c1-2-27-18(24)16-15-17(23)20-14-9-8-12(22(25)26)10-13(14)19(15,21-28-16)11-6-4-3-5-7-11/h3-10,15-16,21H,2H2,1H3,(H,20,23)/t15-,16-,19?/m1/s1
InChIKey VUSXOGCIEAXHPW-QNRNLVPOSA-N
Literature Reference Author F.HEANEY,S.BOURKE,D.CUNNINGHAM,P.MCARDLE
Literature Reference Citation J.CHEM.SOC.PERKIN-2,547(1998)
Literature Reference DOI 10.1039/a707857i
Molecular Weight 383.360 g/mol
Solvent CDCl3
Source File Reference UWRU12117