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N-4-NITROPHENYLSULFENYL-N-2-CHLOROBENZYL-L-ALANINE
SpectraBase Compound ID 3WdWDigTyZr
InChI InChI=1S/C16H15ClN2O4S/c1-11(16(20)21)18(10-12-4-2-3-5-15(12)17)24-14-8-6-13(7-9-14)19(22)23/h2-9,11H,10H2,1H3,(H,20,21)
InChIKey PPJZFXKMEZSPDZ-UHFFFAOYSA-N
Mol Weight 366.82 g/mol
Molecular Formula C16H15ClN2O4S
Exact Mass 366.044106 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1GbvSW5qcQ4
Name N-4-NITROPHENYLSULFENYL-N-2-CHLOROBENZYL-L-ALANINE
Compound Number G1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H15ClN2O4S
InChI InChI=1S/C16H15ClN2O4S/c1-11(16(20)21)18(10-12-4-2-3-5-15(12)17)24-14-8-6-13(7-9-14)19(22)23/h2-9,11H,10H2,1H3,(H,20,21)
InChIKey PPJZFXKMEZSPDZ-UHFFFAOYSA-N
Literature Reference Author A.SCOZZAFAVA,C.T.SUPURAN
Literature Reference Citation BIOORG.MED.CHEM.,8,637(2000)
Literature Reference DOI 10.1016/S0968-0896(99)00316-8
Molecular Weight 366.819 g/mol
Solvent DMSO-D6
Source File Reference UWVN20152