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3-CHLORO-6,6-DIMETHYL-4,5,6-TRIHYDRO-2-PHENYL-BENZO-[6,7]-CYCLOHEPTA-[1,2-C]-PYRAZOLE
SpectraBase Compound ID 6ZRWqnKEji7
InChI InChI=1S/C20H19ClN2/c1-20(2)13-12-16-18(15-10-6-7-11-17(15)20)22-23(19(16)21)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3
InChIKey YILMAACJABKJJK-UHFFFAOYSA-N
Mol Weight 322.84 g/mol
Molecular Formula C20H19ClN2
Exact Mass 322.123676 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FwoJEq3ldY8
Name 3-CHLORO-6,6-DIMETHYL-4,5,6-TRIHYDRO-2-PHENYL-BENZO-[6,7]-CYCLOHEPTA-[1,2-C]-PYRAZOLE
Compound Number 3A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C20H19ClN2
InChI InChI=1S/C20H19ClN2/c1-20(2)13-12-16-18(15-10-6-7-11-17(15)20)22-23(19(16)21)14-8-4-3-5-9-14/h3-11H,12-13H2,1-2H3
InChIKey YILMAACJABKJJK-UHFFFAOYSA-N
Literature Reference Author H.A.K.A.EL-AAL,A.M.A.M.EL-KHAWAGA,A.A.KHALAF
Literature Reference Citation EUR.J.CHEM.,5,277(2014)
Literature Reference DOI 10.5155/eurjchem.5.2.277-286.976
Molecular Weight 322.837 g/mol
Solvent CDCl3
Source File Reference UWIR17726