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METHYL-(2S)-2-[(CYANOMETHYL)-AMINO]-3-PHENYLPROPANOATE
SpectraBase Compound ID 1C7QEoVgs7m
InChI InChI=1S/C12H14N2O2/c1-16-12(15)11(14-8-7-13)9-10-5-3-2-4-6-10/h2-6,11,14H,8-9H2,1H3/t11-/m0/s1
InChIKey BUUPEPHMSDSQLX-NSHDSACASA-N
Mol Weight 218.26 g/mol
Molecular Formula C12H14N2O2
Exact Mass 218.105528 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FrkUAk6R1hU
Name METHYL-(2S)-2-[(CYANOMETHYL)-AMINO]-3-PHENYLPROPANOATE
Compound Number 3E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H14N2O2
InChI InChI=1S/C12H14N2O2/c1-16-12(15)11(14-8-7-13)9-10-5-3-2-4-6-10/h2-6,11,14H,8-9H2,1H3/t11-/m0/s1
InChIKey BUUPEPHMSDSQLX-NSHDSACASA-N
Literature Reference Author A.R.KATRITZKY,N.KIRICHENKO,B.V.ROGOVOY,H.Y.HE
Literature Reference Citation J.ORG.CHEM.,68,9088(2003)
Literature Reference DOI 10.1021/jo026622f
Molecular Weight 218.255 g/mol
Solvent CDCl3
Source File Reference UWSI22802