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1-(N-HEXYL)-3-METHYL-2-PYRAZOLIN-5-ONE

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1-(N-HEXYL)-3-METHYL-2-PYRAZOLIN-5-ONE
SpectraBase Compound ID 4FiaEVheRSE
InChI InChI=1S/C10H18N2O/c1-3-4-5-6-7-12-10(13)8-9(2)11-12/h3-8H2,1-2H3
InChIKey OIPPWAMVRPIVHF-UHFFFAOYSA-N
Mol Weight 182.27 g/mol
Molecular Formula C10H18N2O
Exact Mass 182.141913 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EiaunoxY71n
Name 1-(N-HEXYL)-3-METHYL-2-PYRAZOLIN-5-ONE
Compound Number 2
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C10H18N2O
InChI InChI=1S/C10H18N2O/c1-3-4-5-6-7-12-10(13)8-9(2)11-12/h3-8H2,1-2H3
InChIKey OIPPWAMVRPIVHF-UHFFFAOYSA-N
Literature Reference Author J.BELMAR,F.R.PEREZ,J.ALDERETE,C.ZUNIGA
Literature Reference Citation J.BRAZ.CHEM.SOC.,16,179(2005)
Molecular Weight 182.266 g/mol
Solvent CDCl3
Source File Reference UWLU7064