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4-IODO-1-(1-OXO-3-PHENYLPROPYL)-1H-PYRAZOLE

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4-IODO-1-(1-OXO-3-PHENYLPROPYL)-1H-PYRAZOLE
SpectraBase Compound ID CXuBinFLfCv
InChI InChI=1S/C12H11IN2O/c13-11-8-14-15(9-11)12(16)7-6-10-4-2-1-3-5-10/h1-5,8-9H,6-7H2
InChIKey CYVRLWNDFIWZEE-UHFFFAOYSA-N
Mol Weight 326.14 g/mol
Molecular Formula C12H11IN2O
Exact Mass 325.991608 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID InxBn41M12B
Name 4-IODO-1-(1-OXO-3-PHENYLPROPYL)-1H-PYRAZOLE
Compound Number 5B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H11IN2O
InChI InChI=1S/C12H11IN2O/c13-11-8-14-15(9-11)12(16)7-6-10-4-2-1-3-5-10/h1-5,8-9H,6-7H2
InChIKey CYVRLWNDFIWZEE-UHFFFAOYSA-N
Literature Reference Author W.HOLZER,I.POECHER
Literature Reference Citation J.HETCYCL.CHEM.,32,189(1995)
Literature Reference DOI 10.1002/jhet.5570320131
Molecular Weight 326.137 g/mol
Solvent CDCl3
Source File Reference UWCS20646