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(Z)-2,4-DIHYDRO-4-[(HYDROXYAMINO)-METHYLIDENE]-5-METHYL-2-PHENYL-3H-PYRAZOL-3-ONE;ISOMER-X
SpectraBase Compound ID 6adjQDUsymr
InChI InChI=1S/C11H11N3O2/c1-8-10(7-12-16)11(15)14(13-8)9-5-3-2-4-6-9/h2-7,10,16H,1H3/b12-7-
InChIKey HICMEURGXPLRPO-GHXNOFRVSA-N
Mol Weight 217.23 g/mol
Molecular Formula C11H11N3O2
Exact Mass 217.085127 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4snSuFWMEk8
Name (Z)-2,4-DIHYDRO-4-[(HYDROXYAMINO)-METHYLIDENE]-5-METHYL-2-PHENYL-3H-PYRAZOL-3-ONE;ISOMER-Y
Compound Number 3D
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H10N3O2
InChI InChI=1S/C11H11N3O2/c1-8-10(7-12-16)11(15)14(13-8)9-5-3-2-4-6-9/h2-7,10,16H,1H3/b12-7-
InChIKey HICMEURGXPLRPO-GHXNOFRVSA-N
Literature Reference Author W.HOLZER,R.M.CLARAMUNT,M.PEREZ-TORRALBA,D.GUGGI,T.H.BREHMER
Literature Reference Citation J.ORG.CHEM.,68,7943(2003)
Literature Reference DOI 10.1021/jo030131t
Molecular Weight 216.219 g/mol
Solvent DMSO-D6
Source File Reference UWVN20710