John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=Lmh7StkrrsS SpectraBase Spectrum ID=10gTs4yDM6K

(accessed ).
a'-Bromo-a,a,a-trifluoro-p-xylene
SpectraBase Compound ID Lmh7StkrrsS
InChI InChI=1S/C8H6BrF3/c9-5-6-1-3-7(4-2-6)8(10,11)12/h1-4H,5H2
InChIKey IKSNDOVDVVPSMA-UHFFFAOYSA-N
Mol Weight 239.04 g/mol
Molecular Formula C8H6BrF3
Exact Mass 237.960496 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 10gTs4yDM6K
Name alpha'-BROMO-alpha,alpha,alpha-TRIFLUORO-p-XYLENE
Source of Sample Fluka AG, Buchs, Switzerland
CAS Registry Number 402-49-3
Copyright Copyright © 1980, 1981-2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6BrF3
InChI InChI=1S/C8H6BrF3/c9-5-6-1-3-7(4-2-6)8(10,11)12/h1-4H,5H2
InChIKey IKSNDOVDVVPSMA-UHFFFAOYSA-N
Melting Point 25-30C
Molecular Weight 239.04
Solvent Chloroform-d; Reference=TMS Spectrometer= Varian CFT-20
SpectraBase Batch ID B0p2BbIv4Sw
Synonyms P-XYLENE, A'-BROMO-A,A,A-TRIFLUORO-,