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N-4-NITROPHENYLSULFENYL-N-2-NITROBENZYL-L-ALANINE

View entire compound with spectra: 1 NMR

N-4-NITROPHENYLSULFENYL-N-2-NITROBENZYL-L-ALANINE
SpectraBase Compound ID Lv1aGMP4iR0
InChI InChI=1S/C16H15N3O6S/c1-11(16(20)21)17(10-12-4-2-3-5-15(12)19(24)25)26-14-8-6-13(7-9-14)18(22)23/h2-9,11H,10H2,1H3,(H,20,21)
InChIKey CHEKKGBWGZRBNR-UHFFFAOYSA-N
Mol Weight 377.37 g/mol
Molecular Formula C16H15N3O6S
Exact Mass 377.068156 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CjGlqnZFKFX
Name N-4-NITROPHENYLSULFENYL-N-2-NITROBENZYL-L-ALANINE
Compound Number G-1
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H15N3O6S
InChI InChI=1S/C16H15N3O6S/c1-11(16(20)21)17(10-12-4-2-3-5-15(12)19(24)25)26-14-8-6-13(7-9-14)18(22)23/h2-9,11H,10H2,1H3,(H,20,21)
InChIKey CHEKKGBWGZRBNR-UHFFFAOYSA-N
Literature Reference Author B.W.CLARE,A.SCOZZAFAVA,C.T.SUPURAN
Literature Reference Citation J.MED.CHEM.,44,2253(2001)
Literature Reference DOI 10.1021/jm010087e
Molecular Weight 377.372 g/mol
Sample ID 44606
Solvent DMSO-D6