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[1-(4-Chlorophenyl)-5-(trifluoromethyl)-1H-1,2,3-triazol-4-yl](thien-2-yl)methanone

View entire compound with spectra: 1 NMR, and 1 MS (GC)

[1-(4-Chlorophenyl)-5-(trifluoromethyl)-1H-1,2,3-triazol-4-yl](thien-2-yl)methanone
SpectraBase Compound ID YbhuXdIBv7
InChI InChI=1S/C14H7ClF3N3OS/c15-8-3-5-9(6-4-8)21-13(14(16,17)18)11(19-20-21)12(22)10-2-1-7-23-10/h1-7H
InChIKey JDPPZFWYELAEIW-UHFFFAOYSA-N
Mol Weight 357.74 g/mol
Molecular Formula C14H7ClF3N3OS
Exact Mass 356.995045 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Atph0ukTxuo
Name [1-(4-Chlorophenyl)-5-(trifluoromethyl)-1H-1,2,3-triazol-4-yl](thien-2-yl)methanone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 356.995045219 u
Formula C14H7ClF3N3OS
InChI InChI=1S/C14H7ClF3N3OS/c15-8-3-5-9(6-4-8)21-13(14(16,17)18)11(19-20-21)12(22)10-2-1-7-23-10/h1-7H
InChIKey JDPPZFWYELAEIW-UHFFFAOYSA-N
Molecular Weight 357.738 g/mol
SMILES C1(=C(N(C2=CC=C(C=C2)Cl)N=N1)C(F)(F)F)C(C=1SC=CC1)=O