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ISOPROPYL-1-BENZYL-6-OXO-5-PHENYL-1,4,5,6-TETRAHYDROPYRIDAZINE-3-CARBOXYLATE
SpectraBase Compound ID JmJjrAOBBl3
InChI InChI=1S/C21H22N2O3/c1-15(2)26-21(25)19-13-18(17-11-7-4-8-12-17)20(24)23(22-19)14-16-9-5-3-6-10-16/h3-12,15,18H,13-14H2,1-2H3
InChIKey RNOAZSAUHQPMMU-UHFFFAOYSA-N
Mol Weight 350.42 g/mol
Molecular Formula C21H22N2O3
Exact Mass 350.163043 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CesvhG9kEGw
Name ISOPROPYL-1-BENZYL-6-OXO-5-PHENYL-1,4,5,6-TETRAHYDROPYRIDAZINE-3-CARBOXYLATE
Compound Number 11B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H22N2O3
InChI InChI=1S/C21H22N2O3/c1-15(2)26-21(25)19-13-18(17-11-7-4-8-12-17)20(24)23(22-19)14-16-9-5-3-6-10-16/h3-12,15,18H,13-14H2,1-2H3
InChIKey RNOAZSAUHQPMMU-UHFFFAOYSA-N
Literature Reference Author S.ROSCALS,A.ORTEGA,S.MARTIN-ARAGON,P.BERMEJO-BESCOS,A.G.CSAK Y
Literature Reference Citation EUR.J.ORG.CHEM.,2012,5398(2012)
Literature Reference DOI 10.1002/ejoc.201200734
Molecular Weight 350.417 g/mol
Solvent CDCl3
Source File Reference UWLU84159