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(2S)-N-[(2S)-2-CHLOROPROPIONYL]-2-METHYLPROLINE-1H-7-AZA-1,2,3-BENZOTRIAZOLYLESTER
SpectraBase Compound ID DiJRzJ7zGok
InChI InChI=1S/C14H16ClN5O3/c1-9(15)12(21)19-8-4-6-14(19,2)13(22)23-20-11-10(17-18-20)5-3-7-16-11/h3,5,7,9H,4,6,8H2,1-2H3/t9-,14-/m0/s1
InChIKey LRPLCJRFTURCDE-XPTSAGLGSA-N
Mol Weight 337.77 g/mol
Molecular Formula C14H16ClN5O3
Exact Mass 337.094167 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FbL4t2BTIQ1
Name (2S)-N-[(2S)-2-CHLOROPROPIONYL]-2-METHYLPROLINE-1H-7-AZA-1,2,3-BENZOTRIAZOLYLESTER
Compound Number 40
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C14H16ClN5O3
InChI InChI=1S/C14H16ClN5O3/c1-9(15)12(21)19-8-4-6-14(19,2)13(22)23-20-11-10(17-18-20)5-3-7-16-11/h3,5,7,9H,4,6,8H2,1-2H3/t9-,14-/m0/s1
InChIKey LRPLCJRFTURCDE-XPTSAGLGSA-N
Literature Reference Author A.LEWIS,J.WILKIE,T.J.RUTHERFORD,D.GANI
Literature Reference Citation J.CHEM.SOC.PERKIN-1,3777(1998)
Literature Reference DOI 10.1039/a806030d
Molecular Weight 337.766 g/mol
Solvent CDCl3
Source File Reference UWCP9353