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(S)-N-(4'-CYANO)-BENZYL_2-ACETAMIDO-3-METHOXYPROPIONAMIDE
SpectraBase Compound ID J3pSbTWeOPZ
InChI InChI=1S/C14H17N3O3/c1-10(18)17-13(9-20-2)14(19)16-8-12-5-3-11(7-15)4-6-12/h3-6,13H,8-9H2,1-2H3,(H,16,19)(H,17,18)/t13-/m0/s1
InChIKey USBRRUZBBGJUQY-ZDUSSCGKSA-N
Mol Weight 275.31 g/mol
Molecular Formula C14H17N3O3
Exact Mass 275.126991 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6NGPygv96RZ
Name (S)-N-(4'-CYANO)-BENZYL_2-ACETAMIDO-3-METHOXYPROPIONAMIDE
Compound Number (S)-28
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H17N3O3
InChI InChI=1S/C14H17N3O3/c1-10(18)17-13(9-20-2)14(19)16-8-12-5-3-11(7-15)4-6-12/h3-6,13H,8-9H2,1-2H3,(H,16,19)(H,17,18)/t13-/m0/s1
InChIKey USBRRUZBBGJUQY-ZDUSSCGKSA-N
Literature Reference Author C.SALOME,E.SALOME-GROSJEAN,K.D.PARK,P.MORIEUX,R.SWENDIMAN,E. DEMARCO,J.P.STABLES,
Literature Reference Citation J.MED.CHEM.,53,1288(2010)
Literature Reference DOI 10.1021/jm901563p
Molecular Weight 275.307 g/mol
Solvent CDCl3
Source File Reference UWMZ46682