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3-(N-(4-CHLOROPHENYL)-AMINO)-CYCLOHEX-2-EN-1-ONE
SpectraBase Compound ID 9ETHU7wVUOd
InChI InChI=1S/C12H12ClNO/c13-9-4-6-10(7-5-9)14-11-2-1-3-12(15)8-11/h4-8,14H,1-3H2
InChIKey RGPTVCHISMSLQC-UHFFFAOYSA-N
Mol Weight 221.69 g/mol
Molecular Formula C12H12ClNO
Exact Mass 221.060742 g/mol

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

17O Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2x0ExTniSkT
Name 3-(N-(4-CHLOROPHENYL)-AMINO)-CYCLOHEX-2-EN-1-ONE
Compound Number 3F
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H12ClNO
InChI InChI=1S/C12H12ClNO/c13-9-4-6-10(7-5-9)14-11-2-1-3-12(15)8-11/h4-8,14H,1-3H2
InChIKey RGPTVCHISMSLQC-UHFFFAOYSA-N
Literature Reference Author J.C.ZHUO
Literature Reference Citation MAGN.RES.CHEM.,35,311(1997)
Literature Reference DOI 10.1002/(sici)1097-458x(199705)35:5<311::aid-omr94>3.0.co;2-m
Solvent CH3CN
Source File Reference UWCP4621