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4-(m-chlorophenyl)-alpha-methyl-1-piperazineacetonitrile
SpectraBase Compound ID Bl70WInAel1
InChI InChI=1S/C13H16ClN3/c1-11(10-15)16-5-7-17(8-6-16)13-4-2-3-12(14)9-13/h2-4,9,11H,5-8H2,1H3
InChIKey AIFDHWWBSPWFDH-UHFFFAOYSA-N
Mol Weight 249.74 g/mol
Molecular Formula C13H16ClN3
Exact Mass 249.103275 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1PJFKxNbWFk
Name 4-(m-CHLOROPHENYL)-alpha-METHYL-1-PIPERAZINEACETONITRILE
Source of Sample C. Pollard & L. Hughes, University of Florida, Gainesville, Florida
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H16ClN3
InChI InChI=1S/C13H16ClN3/c1-11(10-15)16-5-7-17(8-6-16)13-4-2-3-12(14)9-13/h2-4,9,11H,5-8H2,1H3
InChIKey AIFDHWWBSPWFDH-UHFFFAOYSA-N
Melting Point 98.5-99.5C
Molecular Weight 249.75
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms 1-PIPERAZINEACETONITRILE, 4-/M-CHLOROPHENYL/-A-METHYL-,