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3-(3',6'-DIOXAHEPTYL)-5-ETHYL-1-METHYLPYRAZOLE-3,5-DICARBOXYLATE
SpectraBase Compound ID LbeYLUpnoD4
InChI InChI=1S/C13H20N2O6/c1-4-20-13(17)11-9-10(14-15(11)2)12(16)21-8-7-19-6-5-18-3/h9H,4-8H2,1-3H3
InChIKey VLJLMHWNNFATRJ-UHFFFAOYSA-N
Mol Weight 300.31 g/mol
Molecular Formula C13H20N2O6
Exact Mass 300.132136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6pdJl6pa0In
Name 3-(3',6'-DIOXAHEPTYL)-5-ETHYL-1-METHYLPYRAZOLE-3,5-DICARBOXYLATE
Compound Number 6B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H20N2O6
InChI InChI=1S/C13H20N2O6/c1-4-20-13(17)11-9-10(14-15(11)2)12(16)21-8-7-19-6-5-18-3/h9H,4-8H2,1-3H3
InChIKey VLJLMHWNNFATRJ-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 300.312 g/mol
Solvent Unknown
Source File Reference UWCP6376