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3-(Trifluoromethyl)pyrazole

View entire compound with spectra: 5 NMR, 3 FTIR, 1 Raman, and 1 MS (GC)

3-(Trifluoromethyl)pyrazole
SpectraBase Compound ID DMjdCT6FaB4
InChI InChI=1S/C4H3F3N2/c5-4(6,7)3-1-2-8-9-3/h1-2H,(H,8,9)
InChIKey PYXNITNKYBLBMW-UHFFFAOYSA-N
Mol Weight 136.08 g/mol
Molecular Formula C4H3F3N2
Exact Mass 136.024833 g/mol

13C Nuclear Magnetic Resonance (NMR) Spectrum

13C Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IylOg0ay61Z
Name 3-(Trifluoromethyl)pyrazole
Source of Sample Sigma-Aldrich Co. LLC.
Catalog Number 406228
CAS Registry Number 20154-03-4
Copyright Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved.
Formula C4H3F3N2
InChI InChI=1S/C4H3F3N2/c5-4(6,7)3-1-2-8-9-3/h1-2H,(H,8,9)
InChIKey PYXNITNKYBLBMW-UHFFFAOYSA-N
Observed nucleus 13C
Purity 99%
Solvent CDCl3
Source of Spectrum Sigma-Aldrich Co. LLC.
Wiley ID SIAL_13CNMR_008914