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OGOBINRVCUWLGN-UHFFFAOYSA-N

View entire compound with spectra: 16 NMR, 5 FTIR, 1 Raman, and 1 MS (GC)

OGOBINRVCUWLGN-UHFFFAOYSA-N
SpectraBase Compound ID GTklcrTVMtn
InChI InChI=1S/C8H4F3N/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-4H
InChIKey OGOBINRVCUWLGN-UHFFFAOYSA-N
Mol Weight 171.12 g/mol
Molecular Formula C8H4F3N
Exact Mass 171.029584 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AoSaJNaxcqr
Name alpha,alpha,alpha-TRIFLUORO-m-TOLUNITRILE
Source of Sample Aldrich Chemical Company, Inc., Milwaukee, Wisconsin
Boiling Point 189C
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H4F3N
InChI InChI=1S/C8H4F3N/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-4H
InChIKey OGOBINRVCUWLGN-UHFFFAOYSA-N
Melting Point 14.5C
Molecular Weight 171.12
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
Synonyms M-TOLUNITRILE, A,A,A-TRIFLUORO-,