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BENZYL-(2S)-2-BENZYLOXYCARBONYLAMINO-3-[5-HYDROXY-1-(PARA-NITROPHENYL)-PYRAZOL-4-YL]-PROPIONATE
SpectraBase Compound ID 9HMlHsBTqjf
InChI InChI=1S/C27H24N4O7/c32-25-21(16-28-30(25)22-11-13-23(14-12-22)31(35)36)15-24(26(33)37-17-19-7-3-1-4-8-19)29-27(34)38-18-20-9-5-2-6-10-20/h1-14,16,24,32H,15,17-18H2,(H,29,34)/t24-/m0/s1
InChIKey VTAOARGLTHPBDZ-DEOSSOPVSA-N
Mol Weight 516.51 g/mol
Molecular Formula C27H24N4O7
Exact Mass 516.164499 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JCyQdVhjHer
Name BENZYL-(2S)-2-BENZYLOXYCARBONYLAMINO-3-[5-HYDROXY-1-(PARA-NITROPHENYL)-PYRAZOL-4-YL]-PROPIONATE
Compound Number 9D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C27H24N4O7
InChI InChI=1S/C27H24N4O7/c32-25-21(16-28-30(25)22-11-13-23(14-12-22)31(35)36)15-24(26(33)37-17-19-7-3-1-4-8-19)29-27(34)38-18-20-9-5-2-6-10-20/h1-14,16,24,32H,15,17-18H2,(H,29,34)/t24-/m0/s1
InChIKey VTAOARGLTHPBDZ-DEOSSOPVSA-N
Literature Reference Author A.N.BOWLER,A.DINSMORE,P.M.DOYLE,D.W.YOUNG
Literature Reference Citation J.CHEM.SOC.PERKIN-1,1297(1997)
Literature Reference DOI 10.1039/a608067g
Molecular Weight 516.510 g/mol
Solvent DMSO-D6