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N-(2-[1-Benzyl-1H-1,2,3-triazol-4-yl]propan-2-yl)-3-(4-fluorophenyl)-2,2-dimethylpropanamide
SpectraBase Compound ID KyJqd6rK5hj
InChI InChI=1S/C23H27FN4O/c1-22(2,14-17-10-12-19(24)13-11-17)21(29)25-23(3,4)20-16-28(27-26-20)15-18-8-6-5-7-9-18/h5-13,16H,14-15H2,1-4H3,(H,25,29)
InChIKey MLRUQRWZLNLMIH-UHFFFAOYSA-N
Mol Weight 394.49 g/mol
Molecular Formula C23H27FN4O
Exact Mass 394.21689 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hKqliiFNXA
Name N-(2-[1-Benzyl-1H-1,2,3-triazol-4-yl]propan-2-yl)-3-(4-fluorophenyl)-2,2-dimethylpropanamide
Alternate Name(s) N-(2-(1-benzyl-1H-1,2,3-triazol-4-yl)propan-2-yl)-3-(4-fluorophenyl)-2,2-dimethylpropanamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27FN4O
InChI InChI=1S/C23H27FN4O/c1-22(2,14-17-10-12-19(24)13-11-17)21(29)25-23(3,4)20-16-28(27-26-20)15-18-8-6-5-7-9-18/h5-13,16H,14-15H2,1-4H3,(H,25,29)
InChIKey MLRUQRWZLNLMIH-UHFFFAOYSA-N
Literature Reference DOI 10.1002/anie.201311024
Molecular Weight 394.494 g/mol
SMILES N(C(C)(C)c1nn[n](c1)Cc1ccccc1)C(=O)C(Cc1ccc(cc1)F)(C)C
SPLASH splash10-0f6x-9344000000-14609344d1ee130e4a48
Source of Spectrum ACI-53-SMS17-7c
Wiley ID 1782264