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5-Fluoro-2-methylbenzonitrile

View entire compound with spectra: 4 NMR, 3 FTIR, and 1 Raman

5-Fluoro-2-methylbenzonitrile
SpectraBase Compound ID A9Goagkr1GW
InChI InChI=1S/C8H6FN/c1-6-2-3-8(9)4-7(6)5-10/h2-4H,1H3
InChIKey IBRODYNXELBTJC-UHFFFAOYSA-N
Mol Weight 135.14 g/mol
Molecular Formula C8H6FN
Exact Mass 135.048427 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3eDuMoCkGPx
Name 5-Fluoro-2-methylbenzonitrile
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 364916
CAS Registry Number 77532-79-7
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C8H6FN
InChI InChI=1S/C8H6FN/c1-6-2-3-8(9)4-7(6)5-10/h2-4H,1H3
InChIKey IBRODYNXELBTJC-UHFFFAOYSA-N
Observed nucleus 13C
Purity 98%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_007673