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(3E)-5,5,5-Trichloro-3-penten-2-one
SpectraBase Compound ID HW4zM01jfYY
InChI InChI=1S/C5H5Cl3O/c1-4(9)2-3-5(6,7)8/h2-3H,1H3/b3-2+
InChIKey WYTWCHDMETZZSN-NSCUHMNNSA-N
Mol Weight 187.45 g/mol
Molecular Formula C5H5Cl3O
Exact Mass 185.940598 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CqKPQCFUkii
Name (E)-5,5,5-TRICHLOROPENT-3-EN-2-ONE
Comments ##
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Formula C5H5Cl3O
InChI InChI=1S/C5H5Cl3O/c1-4(9)2-3-5(6,7)8/h2-3H,1H3/b3-2+
InChIKey WYTWCHDMETZZSN-NSCUHMNNSA-N
Instrument Name Jeol FX-90
Literature Reference V.V.SHEPIN, A.S.RODYGIN, B.Z.PERTSIKOV (1991) Zhurn.Org.Khim.(Russ. Lang.):v.27, N2, 257-261.
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3 chloroform-d