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3-(1-(ORTHO-NITROBENZYL)-1H-IMIDAZOL-4-YL)-2-BENZYLOXYCARBONYLAMINO-ACRYLIC-ACID-METHYLESTER
SpectraBase Compound ID gKo3kqFLA8
InChI InChI=1S/C22H20N4O6/c1-31-21(27)19(24-22(28)32-14-16-7-3-2-4-8-16)11-18-13-25(15-23-18)12-17-9-5-6-10-20(17)26(29)30/h2-11,13,15H,12,14H2,1H3,(H,24,28)/b19-11-
InChIKey BLKYZKWNAMNZOG-ODLFYWEKSA-N
Mol Weight 436.42 g/mol
Molecular Formula C22H20N4O6
Exact Mass 436.138284 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6UFwWAr66lz
Name 3-(1-(ORTHO-NITROBENZYL)-1H-IMIDAZOL-4-YL)-2-BENZYLOXYCARBONYLAMINO-ACRYLIC-ACID-METHYLESTER
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H20N4O6
InChI InChI=1S/C22H20N4O6/c1-31-21(27)19(24-22(28)32-14-16-7-3-2-4-8-16)11-18-13-25(15-23-18)12-17-9-5-6-10-20(17)26(29)30/h2-11,13,15H,12,14H2,1H3,(H,24,28)/b19-11-
InChIKey BLKYZKWNAMNZOG-ODLFYWEKSA-N
Literature Reference Author B.M.SCHIAVI,D.J.RICHARD,M.M.JOULLIE
Literature Reference Citation J.ORG.CHEM.,67,620(2002)
Literature Reference DOI 10.1021/jo0106593
Molecular Weight 436.424 g/mol
Solvent CDCl3
Source File Reference UWMS23161