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p-CHLORO-beta-(alpha,alpha,alpha-TRIFLUORO-m-TOLUIDINO)ATROPONITRILE

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

p-CHLORO-beta-(alpha,alpha,alpha-TRIFLUORO-m-TOLUIDINO)ATROPONITRILE
SpectraBase Compound ID JChDb1233s3
InChI InChI=1S/C16H10ClF3N2/c17-14-6-4-11(5-7-14)12(9-21)10-22-15-3-1-2-13(8-15)16(18,19)20/h1-8,10,22H
InChIKey HQGGNITXQSNFOQ-UHFFFAOYSA-N
Mol Weight 322.72 g/mol
Molecular Formula C16H10ClF3N2
Exact Mass 322.048461 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID KtjZCDzOLSK
Name p-CHLORO-beta-(alpha,alpha,alpha-TRIFLUORO-m-TOLUIDINO)ATROPONITRILE
Source of Sample Bionet Research Ltd., Cornwall, England
Copyright Copyright © 1991-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H10ClF3N2
InChI InChI=1S/C16H10ClF3N2/c17-14-6-4-11(5-7-14)12(9-21)10-22-15-3-1-2-13(8-15)16(18,19)20/h1-8,10,22H
InChIKey HQGGNITXQSNFOQ-UHFFFAOYSA-N
Instrument Name BRUKER AC-300
Melting Point 169-171C
Molecular Weight 322.72
Solvent DMSO-d6; Reference=TMS; Temperature 297K