Debug Info

object
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_id
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KInD8MgtVM9
spectrumID
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KInD8MgtVM9
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262144
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analyticalTechnique
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13C NMR
analyticalTechniqueLongName
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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compound
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1-(4'-CHLORO-3'-METHYLPHENYL)-3-(3'',4''-DIMETHYLPHENYL)-PROP-2-ENE-1-ONE
SpectraBase Compound ID 7IuYtvk31tg
InChI InChI=1S/C18H17ClO/c1-12-4-5-15(10-13(12)2)6-9-18(20)16-7-8-17(19)14(3)11-16/h4-11H,1-3H3/b9-6+
InChIKey WDCFCMUNQKUJMB-RMKNXTFCSA-N
Mol Weight 284.79 g/mol
Molecular Formula C18H17ClO
Exact Mass 284.096793 g/mol
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13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KInD8MgtVM9
Name 1-(4'-CHLORO-3'-METHYLPHENYL)-3-(3'',4''-DIMETHYLPHENYL)-PROP-2-ENE-1-ONE
Compound Number 7D
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H17ClO
InChI InChI=1S/C18H17ClO/c1-12-4-5-15(10-13(12)2)6-9-18(20)16-7-8-17(19)14(3)11-16/h4-11H,1-3H3/b9-6+
InChIKey WDCFCMUNQKUJMB-RMKNXTFCSA-N
Literature Reference Author K.M.HUCCHEGOWDA,B.Y.BASAVAIAH,U.BASAVAIAH,S.S.BASAVAIAH
Literature Reference Citation EUR.J.CHEM.,5,584(2014)
Literature Reference DOI 10.5155/eurjchem.5.4.584-587.1093
Molecular Weight 284.785 g/mol
Solvent DMSO-D6
Source File Reference UWIR17766
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