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3-ETHOXYCARBONYL-1,3,3A,9B-TETRAHYDRO-1-(3-OXOBUTYL)-ISOXAZOLO-[4,3-C]-QUINOLIN-4(5H)-ONE
SpectraBase Compound ID 9Rm3ou0RivF
InChI InChI=1S/C17H20N2O5/c1-3-23-17(22)15-13-14(19(24-15)9-8-10(2)20)11-6-4-5-7-12(11)18-16(13)21/h4-7,13-15H,3,8-9H2,1-2H3,(H,18,21)/t13-,14+,15-/m0/s1
InChIKey AEPZXCCSDTYXSV-ZNMIVQPWSA-N
Mol Weight 332.36 g/mol
Molecular Formula C17H20N2O5
Exact Mass 332.137222 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Um0T52JOPe
Name 3-ETHOXYCARBONYL-1,3,3A,9B-TETRAHYDRO-1-(3-OXOBUTYL)-ISOXAZOLO-[4,3-C]-QUINOLIN-4(5H)-ONE
Compound Number 11C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H20N2O5
InChI InChI=1S/C17H20N2O5/c1-3-23-17(22)15-13-14(19(24-15)9-8-10(2)20)11-6-4-5-7-12(11)18-16(13)21/h4-7,13-15H,3,8-9H2,1-2H3,(H,18,21)/t13-,14+,15-/m0/s1
InChIKey AEPZXCCSDTYXSV-ZNMIVQPWSA-N
Literature Reference Author F.HEANEY,S.BOURKE
Literature Reference Citation J.CHEM.SOC.PERKIN-1,955(1998)
Literature Reference DOI 10.1039/a707078k
Molecular Weight 332.356 g/mol
Solvent CDCl3
Source File Reference UWGE2520