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2-(METHYLSULFINYL)-1-(2-PYRAZYL)-ETHANOL
SpectraBase Compound ID FBgqWxEnr9H
InChI InChI=1S/C7H10N2O2S/c1-12(11)5-7(10)6-4-8-2-3-9-6/h2-4,7,10H,5H2,1H3/t7-,12?/m0/s1
InChIKey PWNLQOIMBTYWQP-KAJCPDDVSA-N
Mol Weight 186.23 g/mol
Molecular Formula C7H10N2O2S
Exact Mass 186.046299 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CajsmvrLhBS
Name 2-(METHYLSULFINYL)-1-(2-PYRAZYL)-ETHANOL
Compound Number 3C -BETA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H10N2O2S
InChI InChI=1S/C7H10N2O2S/c1-12(11)5-7(10)6-4-8-2-3-9-6/h2-4,7,10H,5H2,1H3/t7-,12?/m0/s1
InChIKey PWNLQOIMBTYWQP-KAJCPDDVSA-N
Literature Reference Author C.ALVAREZ-IBARRA,R.CUERVO-RODRIGUEZ,M.C.FERNANDEZ-MONREAL,M. P.RUIZ
Literature Reference Citation J.ORG.CHEM.,59,7284(1994)
Literature Reference DOI 10.1021/jo00103a019
Molecular Weight 186.229 g/mol
Solvent CDCl3
Source File Reference UWCP7514