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4-ETHOXYTHIOCARBONYL-5-HYDROXY-3-METHYL-1-PHENYLPYRAZOLE
SpectraBase Compound ID E9TZzxUuFVF
InChI InChI=1S/C13H14N2O2S/c1-3-17-13(18)11-9(2)14-15(12(11)16)10-7-5-4-6-8-10/h4-8,16H,3H2,1-2H3
InChIKey XDBMZUSLASDQMA-UHFFFAOYSA-N
Mol Weight 262.33 g/mol
Molecular Formula C13H14N2O2S
Exact Mass 262.077599 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CzARUIbaMuF
Name 4-ETHOXYTHIOCARBONYL-5-HYDROXY-3-METHYL-1-PHENYLPYRAZOLE
Compound Number 4A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H14N2O2S
InChI InChI=1S/C13H14N2O2S/c1-3-17-13(18)11-9(2)14-15(12(11)16)10-7-5-4-6-8-10/h4-8,16H,3H2,1-2H3
InChIKey XDBMZUSLASDQMA-UHFFFAOYSA-N
Literature Reference Author R.LOPEZ,G.LEON,A.OLIVA
Literature Reference Citation J.HETCYCL.CHEM.,32,1377(1995)
Literature Reference DOI 10.1002/jhet.5570320445
Molecular Weight 262.326 g/mol
Solvent CDCl3
Source File Reference UWGE1521