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METHYL-5-[4-(ACETYLAMINO)-PHENYLSULFONAMIDE]-5-OXOPENTANOATE
SpectraBase Compound ID sPLgWuqIt8
InChI InChI=1S/C14H18N2O6S/c1-10(17)15-11-6-8-12(9-7-11)23(20,21)16-13(18)4-3-5-14(19)22-2/h6-9H,3-5H2,1-2H3,(H,15,17)(H,16,18)
InChIKey KTLBAARSFMJIEM-UHFFFAOYSA-N
Mol Weight 342.37 g/mol
Molecular Formula C14H18N2O6S
Exact Mass 342.088557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3VATQ999XbC
Name METHYL-5-[4-(ACETYLAMINO)-PHENYLSULFONAMIDE]-5-OXOPENTANOATE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H18N2O6S
InChI InChI=1S/C14H18N2O6S/c1-10(17)15-11-6-8-12(9-7-11)23(20,21)16-13(18)4-3-5-14(19)22-2/h6-9H,3-5H2,1-2H3,(H,15,17)(H,16,18)
InChIKey KTLBAARSFMJIEM-UHFFFAOYSA-N
Literature Reference Author J.ADRIAN,H.FONT,J.M.DISERENS,F.SANCHEZ-BAEZA,M.P.MARCO
Literature Reference Citation J.AGR.FOOD.CHEM.,57,385(2009)
Literature Reference DOI 10.1021/jf8027655
Molecular Weight 342.367 g/mol
Sample ID 67915
Solvent CDCl3:CD3OD=14:1