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4-AMINO-3-BENZYL-1-(4-CHLOROPHENYL)-1H-PYRAZOLE-5-CARBONITRILE

View entire compound with spectra: 1 NMR

4-AMINO-3-BENZYL-1-(4-CHLOROPHENYL)-1H-PYRAZOLE-5-CARBONITRILE
SpectraBase Compound ID KdknzuQjI8T
InChI InChI=1S/C17H13ClN4/c18-13-6-8-14(9-7-13)22-16(11-19)17(20)15(21-22)10-12-4-2-1-3-5-12/h1-9H,10,20H2
InChIKey BNOQRAKGFSIGRT-UHFFFAOYSA-N
Mol Weight 308.77 g/mol
Molecular Formula C17H13ClN4
Exact Mass 308.082874 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JtLvhxp2cJR
Name 4-AMINO-3-BENZYL-1-(4-CHLOROPHENYL)-1H-PYRAZOLE-5-CARBONITRILE
Compound Number 12A
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H13ClN4
InChI InChI=1S/C17H13ClN4/c18-13-6-8-14(9-7-13)22-16(11-19)17(20)15(21-22)10-12-4-2-1-3-5-12/h1-9H,10,20H2
InChIKey BNOQRAKGFSIGRT-UHFFFAOYSA-N
Literature Reference Author K.D.KHALIL,H.M.A.MATAR
Literature Reference Citation MOLECULES,17,12225(2012)
Literature Reference DOI 10.3390/molecules171012225
Molecular Weight 308.770 g/mol
Sample ID 1843
Solvent DMSO-D6