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DIOCTYL-1-METHYLPYRAZOLE-3,5-DICARBOXYLATE
SpectraBase Compound ID oCbQBhOvyr
InChI InChI=1S/C22H38N2O4/c1-4-6-8-10-12-14-16-27-21(25)19-18-20(24(3)23-19)22(26)28-17-15-13-11-9-7-5-2/h18H,4-17H2,1-3H3
InChIKey MHFGXTVKGYGKRS-UHFFFAOYSA-N
Mol Weight 394.6 g/mol
Molecular Formula C22H38N2O4
Exact Mass 394.283158 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LdEyEmI1NHm
Name DIOCTYL-1-METHYLPYRAZOLE-3,5-DICARBOXYLATE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H38N2O4
InChI InChI=1S/C22H38N2O4/c1-4-6-8-10-12-14-16-27-21(25)19-18-20(24(3)23-19)22(26)28-17-15-13-11-9-7-5-2/h18H,4-17H2,1-3H3
InChIKey MHFGXTVKGYGKRS-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 394.555 g/mol
Solvent Unknown
Source File Reference UWCP6364