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1-(o-chlorobenzoyl)-3-cyclopropyl-5-(methylthio)pyrazole-4-carbonitrile

View entire compound with spectra: 3 NMR, and 1 FTIR

1-(o-chlorobenzoyl)-3-cyclopropyl-5-(methylthio)pyrazole-4-carbonitrile
SpectraBase Compound ID FfnDTF7UM2N
InChI InChI=1S/C15H12ClN3OS/c1-21-15-11(8-17)13(9-6-7-9)18-19(15)14(20)10-4-2-3-5-12(10)16/h2-5,9H,6-7H2,1H3
InChIKey SRNZSFXUAWKLES-UHFFFAOYSA-N
Mol Weight 317.79 g/mol
Molecular Formula C15H12ClN3OS
Exact Mass 317.038961 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KG0hhEmexYz
Name 1-(o-CHLOROBENZOYL)-3-CYCLOPROPYL-5-(METHYLTHIO)PYRAZOLE-4-CARBONITRILE
Source of Sample Maybridge Chemical Company Ltd., North Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H12ClN3OS
InChI InChI=1S/C15H12ClN3OS/c1-21-15-11(8-17)13(9-6-7-9)18-19(15)14(20)10-4-2-3-5-12(10)16/h2-5,9H,6-7H2,1H3
InChIKey SRNZSFXUAWKLES-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 94-97C
Molecular Weight 317.80
Solvent CDCl3; Reference=TMS; Temperature 297K