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3-ETHYL-5-OCTYL-1-METHYLPYRAZOLE-3,5-DICARBOXYLATE
SpectraBase Compound ID IIoxQRqdS3u
InChI InChI=1S/C16H26N2O4/c1-4-6-7-8-9-10-11-22-16(20)14-12-13(17-18(14)3)15(19)21-5-2/h12H,4-11H2,1-3H3
InChIKey NXKWFFNQAGVXPS-UHFFFAOYSA-N
Mol Weight 310.39 g/mol
Molecular Formula C16H26N2O4
Exact Mass 310.189257 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DwFHOL64HSe
Name 3-ETHYL-5-OCTYL-1-METHYLPYRAZOLE-3,5-DICARBOXYLATE
Compound Number 4B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H26N2O4
InChI InChI=1S/C16H26N2O4/c1-4-6-7-8-9-10-11-22-16(20)14-12-13(17-18(14)3)15(19)21-5-2/h12H,4-11H2,1-3H3
InChIKey NXKWFFNQAGVXPS-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 310.393 g/mol
Solvent Unknown
Source File Reference UWCP6366