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8-METHOXY-2-(1'-METHYLETHYL)-5-METHYL-4-OXO-4,5-DIHYDROFURO-[3,2-C]-QUINOLIN-3-SULPHONAT-SODIUM
SpectraBase Compound ID FkoA3Ki0gGb
InChI InChI=1S/C16H17NO6S.Na/c1-8(2)13-15(24(19,20)21)12-14(23-13)10-7-9(22-4)5-6-11(10)17(3)16(12)18;/h5-8H,1-4H3,(H,19,20,21);/q;+1/p-1
InChIKey IKPYYHZFZRCAHG-UHFFFAOYSA-M
Mol Weight 373.35 g/mol
Molecular Formula C16H16NNaO6S
Exact Mass 373.059603 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JIWrPhWi0vC
Name 8-METHOXY-2-(1'-METHYLETHYL)-5-METHYL-4-OXO-4,5-DIHYDROFURO-[3,2-C]-QUINOLIN-3-SULPHONAT-SODIUM
Compound Number 8A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H16NNaO6S
InChI InChI=1S/C16H17NO6S.Na/c1-8(2)13-15(24(19,20)21)12-14(23-13)10-7-9(22-4)5-6-11(10)17(3)16(12)18;/h5-8H,1-4H3,(H,19,20,21);/q;+1/p-1
InChIKey IKPYYHZFZRCAHG-UHFFFAOYSA-M
Literature Reference Author I.BUTENSCHOEN,K.MOELLER,W.HAENSEL
Literature Reference Citation J.MED.CHEM.,44,1249(2001)
Literature Reference DOI 10.1021/jm001007u
Molecular Weight 373.356 g/mol
Sample ID 44458
Solvent DMSO-D6