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(R,S)-N-BENZYL-2-FORMYLAMINO-3-METHOXYPROPIONAMIDE
SpectraBase Compound ID GGAPTiqJg4p
InChI InChI=1S/C12H16N2O3/c1-17-8-11(14-9-15)12(16)13-7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H,13,16)(H,14,15)
InChIKey KTHBFAPBLPKOQW-UHFFFAOYSA-N
Mol Weight 236.27 g/mol
Molecular Formula C12H16N2O3
Exact Mass 236.116092 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4HLyO5bumsZ
Name (R,S)-N-BENZYL-2-FORMYLAMINO-3-METHOXYPROPIONAMIDE
Compound Number 56
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H16N2O3
InChI InChI=1S/C12H16N2O3/c1-17-8-11(14-9-15)12(16)13-7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H,13,16)(H,14,15)
InChIKey KTHBFAPBLPKOQW-UHFFFAOYSA-N
Literature Reference Author M.SHEN,A.L.TIRAN,Y.XIAO,A.GOLBRAIKH,H.KOHN,A.TROPSHA
Literature Reference Citation J.MED.CHEM.,45,2811(2002)
Literature Reference DOI 10.1021/jm010488u
Molecular Weight 236.271 g/mol
Sample ID 52837
Solvent CDCl3