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BENZYL-(2S)-2-BENZYLOXYCARBONYLAMINO-3-(5-HYDROXYPYRAZOL-4-YL)-PROPIONATE

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BENZYL-(2S)-2-BENZYLOXYCARBONYLAMINO-3-(5-HYDROXYPYRAZOL-4-YL)-PROPIONATE
SpectraBase Compound ID JyASwMdNCx7
InChI InChI=1S/C21H21N3O5/c25-19-17(12-22-24-19)11-18(20(26)28-13-15-7-3-1-4-8-15)23-21(27)29-14-16-9-5-2-6-10-16/h1-10,12,18H,11,13-14H2,(H,23,27)(H2,22,24,25)/t18-/m1/s1
InChIKey KVJWYEXXHILAMS-GOSISDBHSA-N
Mol Weight 395.42 g/mol
Molecular Formula C21H21N3O5
Exact Mass 395.148121 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JysdhuccVmp
Name BENZYL-(2S)-2-BENZYLOXYCARBONYLAMINO-3-(5-HYDROXYPYRAZOL-4-YL)-PROPIONATE
Compound Number 9A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H21N3O5
InChI InChI=1S/C21H21N3O5/c25-19-17(12-22-24-19)11-18(20(26)28-13-15-7-3-1-4-8-15)23-21(27)29-14-16-9-5-2-6-10-16/h1-10,12,18H,11,13-14H2,(H,23,27)(H2,22,24,25)/t18-/m1/s1
InChIKey KVJWYEXXHILAMS-GOSISDBHSA-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 395.415 g/mol
Solvent DMSO-D6