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3-ETHOXYCARBONYL-1,3,3A,11B-TETRAHYDRO-5-METHYL-1-(3-OXOBUTYL)-ISOXAZOLO-[4,3-C]-QUINOLIN-4(5H)-ONE
SpectraBase Compound ID 6vNj6RSU1rK
InChI InChI=1S/C18H22N2O5/c1-4-24-18(23)16-14-15(20(25-16)10-9-11(2)21)12-7-5-6-8-13(12)19(3)17(14)22/h5-8,14-16H,4,9-10H2,1-3H3/t14-,15+,16-/m0/s1
InChIKey ALODPKJGJXYABB-XHSDSOJGSA-N
Mol Weight 346.38 g/mol
Molecular Formula C18H22N2O5
Exact Mass 346.152872 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GBwCxjhVHUf
Name 3-ETHOXYCARBONYL-1,3,3A,11B-TETRAHYDRO-5-METHYL-1-(3-OXOBUTYL)-ISOXAZOLO-[4,3-C]-QUINOLIN-4(5H)-ONE
Compound Number 17A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22N2O5
InChI InChI=1S/C18H22N2O5/c1-4-24-18(23)16-14-15(20(25-16)10-9-11(2)21)12-7-5-6-8-13(12)19(3)17(14)22/h5-8,14-16H,4,9-10H2,1-3H3/t14-,15+,16-/m0/s1
InChIKey ALODPKJGJXYABB-XHSDSOJGSA-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 346.383 g/mol
Solvent CDCl3
Source File Reference UWGE2529