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OMFCXKFOAOZVQX-ZKYTZXILSA-N

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OMFCXKFOAOZVQX-ZKYTZXILSA-N
SpectraBase Compound ID 1zF8WTOa9xw
InChI InChI=1S/C19H18N2O6S/c1-26-19(25)15-11-7-8-12(22)16(11)28-18-14(17(24)21(15)18)20-13(23)9-27-10-5-3-2-4-6-10/h2-8,12,14,16,18,22H,9H2,1H3,(H,20,23)/t12?,14-,16-,18-/m1/s1
InChIKey OMFCXKFOAOZVQX-ZKYTZXILSA-N
Mol Weight 402.42 g/mol
Molecular Formula C19H18N2O6S
Exact Mass 402.088557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KJH9Gp9Etbn
Name OMFCXKFOAOZVQX-ZKYTZXILSA-N
Compound Number 2B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H18N2O6S
InChI InChI=1S/C19H18N2O6S/c1-26-19(25)15-11-7-8-12(22)16(11)28-18-14(17(24)21(15)18)20-13(23)9-27-10-5-3-2-4-6-10/h2-8,12,14,16,18,22H,9H2,1H3,(H,20,23)/t12?,14-,16-,18-/m1/s1
InChIKey OMFCXKFOAOZVQX-ZKYTZXILSA-N
Literature Reference Author J.PITLIK,T.E.GUNDA,G.BETTA,J.JEKOE
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3043(1994)
Literature Reference DOI 10.1039/p19940003043
Molecular Weight 402.422 g/mol
Solvent CDCl3
Source File Reference UWRU4284