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3-ETHYL-5-OCTYL-1-BENZYLPYRAZOLE-3,5-DICARBOXYLATE
SpectraBase Compound ID 5alAmf2y98c
InChI InChI=1S/C22H30N2O4/c1-3-5-6-7-8-12-15-28-22(26)20-16-19(21(25)27-4-2)23-24(20)17-18-13-10-9-11-14-18/h9-11,13-14,16H,3-8,12,15,17H2,1-2H3
InChIKey POYAEJWAWDIYOX-UHFFFAOYSA-N
Mol Weight 386.49 g/mol
Molecular Formula C22H30N2O4
Exact Mass 386.220557 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID nMY0HyxAnZ
Name 3-ETHYL-5-OCTYL-1-BENZYLPYRAZOLE-3,5-DICARBOXYLATE
Compound Number 4C
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H30N2O4
InChI InChI=1S/C22H30N2O4/c1-3-5-6-7-8-12-15-28-22(26)20-16-19(21(25)27-4-2)23-24(20)17-18-13-10-9-11-14-18/h9-11,13-14,16H,3-8,12,15,17H2,1-2H3
InChIKey POYAEJWAWDIYOX-UHFFFAOYSA-N
Literature Reference Author M.FLERROS,M.I.RODRIGUEZ-FRANCO,P.NAVARRO,S.CONDE
Literature Reference Citation HETEROCYCLES,36,2019(1993)
Literature Reference DOI 10.3987/COM-93-6378
Molecular Weight 386.491 g/mol
Solvent Unknown
Source File Reference UWCP6369