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METHYL-3-(PHENYLMETHYL)-AMINO-2-PENTENOATE

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METHYL-3-(PHENYLMETHYL)-AMINO-2-PENTENOATE
SpectraBase Compound ID EGYsfVe8yB5
InChI InChI=1S/C13H17NO2/c1-3-12(9-13(15)16-2)14-10-11-7-5-4-6-8-11/h4-9,14H,3,10H2,1-2H3/b12-9+
InChIKey JBFNVRJQZHFTRZ-FMIVXFBMSA-N
Mol Weight 219.28 g/mol
Molecular Formula C13H17NO2
Exact Mass 219.125929 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EfW7nV9IQWG
Name METHYL-3-(PHENYLMETHYL)-AMINO-2-PENTENOATE
Compound Number 47
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H17NO2
InChI InChI=1S/C13H17NO2/c1-3-12(9-13(15)16-2)14-10-11-7-5-4-6-8-11/h4-9,14H,3,10H2,1-2H3/b12-9+
InChIKey JBFNVRJQZHFTRZ-FMIVXFBMSA-N
Literature Reference Author A.R.MAGUIRE,S.J.PLUNKETT,S.PAPOT,M.CLYNES,R.O.CONNOR,S.TOUHE Y
Literature Reference Citation BIOORG.MED.CHEM.,9,745(2001)
Literature Reference DOI 10.1016/S0968-0896(00)00292-3
Molecular Weight 219.283 g/mol
Solvent CDCl3
Source File Reference UWLU21862