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2-Acetamido-3-benzyl-5-(4-trifluoromethylphenyl)pyrazine

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

2-Acetamido-3-benzyl-5-(4-trifluoromethylphenyl)pyrazine
SpectraBase Compound ID DNKNer0jMUx
InChI InChI=1S/C20H16F3N3O/c1-13(27)25-19-17(11-14-5-3-2-4-6-14)26-18(12-24-19)15-7-9-16(10-8-15)20(21,22)23/h2-10,12H,11H2,1H3,(H,24,25,27)
InChIKey AXJBJCQXZZDNDX-UHFFFAOYSA-N
Mol Weight 371.36 g/mol
Molecular Formula C20H16F3N3O
Exact Mass 371.124547 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID KGybgz9rCfu
Name 2-Acetamido-3-benzyl-5-(4-trifluoromethylphenyl)pyrazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 371.124546635 u
Formula C20H16F3N3O
InChI InChI=1S/C20H16F3N3O/c1-13(27)25-19-17(11-14-5-3-2-4-6-14)26-18(12-24-19)15-7-9-16(10-8-15)20(21,22)23/h2-10,12H,11H2,1H3,(H,24,25,27)
InChIKey AXJBJCQXZZDNDX-UHFFFAOYSA-N
Molecular Weight 371.363 g/mol
SMILES C1(=NC(=CN=C1NC(=O)C)C=1C=CC(C(F)(F)F)=CC1)CC=1C=CC=CC1