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1H-Benzoimidazole, 5,6-dimethyl-2-(3-trifluoromethylphenylmethanesulfonyl)-
SpectraBase Compound ID GhHJT47tgYo
InChI InChI=1S/C17H15F3N2O2S/c1-10-6-14-15(7-11(10)2)22-16(21-14)25(23,24)9-12-4-3-5-13(8-12)17(18,19)20/h3-8H,9H2,1-2H3,(H,21,22)
InChIKey LYCXRMXEMIIVNU-UHFFFAOYSA-N
Mol Weight 368.37 g/mol
Molecular Formula C17H15F3N2O2S
Exact Mass 368.080633 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Cim1dzRsKNh
Name 1H-Benzoimidazole, 5,6-dimethyl-2-(3-trifluoromethylphenylmethanesulfonyl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.080633392 u
Formula C17H15F3N2O2S
InChI InChI=1S/C17H15F3N2O2S/c1-10-6-14-15(7-11(10)2)22-16(21-14)25(23,24)9-12-4-3-5-13(8-12)17(18,19)20/h3-8H,9H2,1-2H3,(H,21,22)
InChIKey LYCXRMXEMIIVNU-UHFFFAOYSA-N
Molecular Weight 368.374 g/mol
SMILES C1(=C(C)C=C2C(=C1)N=C(N2)S(CC1=CC=CC(C(F)(F)F)=C1)(=O)=O)C