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3-Fluoro-5-(trifluoromethyl)benzonitrile

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3-Fluoro-5-(trifluoromethyl)benzonitrile
SpectraBase Compound ID 8Qew0A44zNq
InChI InChI=1S/C8H3F4N/c9-7-2-5(4-13)1-6(3-7)8(10,11)12/h1-3H
InChIKey AYNUKEDZAYOEGG-UHFFFAOYSA-N
Mol Weight 189.11 g/mol
Molecular Formula C8H3F4N
Exact Mass 189.020162 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID F36otEnOYi3
Name alpha,alpha,alpha,5-Tetrafluoro-m-tolunitrile
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 335576
CAS Registry Number 149793-69-1
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H3F4N
InChI InChI=1S/C8H3F4N/c9-7-2-5(4-13)1-6(3-7)8(10,11)12/h1-3H
InChIKey AYNUKEDZAYOEGG-UHFFFAOYSA-N
Observed nucleus 1H
Purity 97%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Synonyms 3-Fluoro-5-(trifluoromethyl)benzonitrile 3-Fluoro-5-(trifluoromethyl)benzonitrile
Wiley ID SIAL_1HNMR_006771