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1-(2,6-DICHLORO-4-TRIFLUOROMETHYL)-3-(6-METHOXY-NAPHTHALEN-2-YL)-1H-PYRAZOLE-4-CARBALDEHYDE
SpectraBase Compound ID DfsuriglFBu
InChI InChI=1S/C22H13Cl2F3N2O2/c1-31-17-5-4-12-6-14(3-2-13(12)7-17)20-15(11-30)10-29(28-20)21-18(23)8-16(9-19(21)24)22(25,26)27/h2-11H,1H3
InChIKey XLJOXTDNDQQOLE-UHFFFAOYSA-N
Mol Weight 465.26 g/mol
Molecular Formula C22H13Cl2F3N2O2
Exact Mass 464.030618 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EtZaNa7b89H
Name 1-(2,6-DICHLORO-4-TRIFLUOROMETHYL)-3-(6-METHOXY-NAPHTHALEN-2-YL)-1H-PYRAZOLE-4-CARBALDEHYDE
Compound Number 6I
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H13Cl2F3N2O2
InChI InChI=1S/C22H13Cl2F3N2O2/c1-31-17-5-4-12-6-14(3-2-13(12)7-17)20-15(11-30)10-29(28-20)21-18(23)8-16(9-19(21)24)22(25,26)27/h2-11H,1H3
InChIKey XLJOXTDNDQQOLE-UHFFFAOYSA-N
Literature Reference Author H.HU,C.GE,L.DING,A.ZHANG
Literature Reference Citation MOLECULES,15,7472(2010)
Literature Reference DOI 10.3390/molecules15107472
Molecular Weight 465.259 g/mol
Sample ID 72562
Solvent CDCl3