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N-{2-[1-(4-methoxybenzyl)-1H-1,2,3-triazol-4-yl]propan-2-yl}-2,6-dimethyl-4-(trifluoromethyl)benzamide
SpectraBase Compound ID 5yOAzFKvTn9
InChI InChI=1S/C23H25F3N4O2/c1-14-10-17(23(24,25)26)11-15(2)20(14)21(31)27-22(3,4)19-13-30(29-28-19)12-16-6-8-18(32-5)9-7-16/h6-11,13H,12H2,1-5H3,(H,27,31)
InChIKey OEVJFFRBCHFETN-UHFFFAOYSA-N
Mol Weight 446.47 g/mol
Molecular Formula C23H25F3N4O2
Exact Mass 446.192961 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3UVrVXRWFoW
Name N-{2-[1-(4-methoxybenzyl)-1H-1,2,3-triazol-4-yl]propan-2-yl}-2,6-dimethyl-4-(trifluoromethyl)benzamide
Appearance Colorless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 446.192960548 u
Formula C23H25F3N4O2
InChI InChI=1S/C23H25F3N4O2/c1-14-10-17(23(24,25)26)11-15(2)20(14)21(31)27-22(3,4)19-13-30(29-28-19)12-16-6-8-18(32-5)9-7-16/h6-11,13H,12H2,1-5H3,(H,27,31)
InChIKey OEVJFFRBCHFETN-UHFFFAOYSA-N
Instrument Name Finnigan MAT 95
Ionization Type EI
Literature Reference DOI 10.1002/chem.201501134
Molecular Weight 446.474 g/mol
Quality 46
Reported Formula C23H25F3N4O2
SMILES N(C(C=1C(=CC(=CC1C)C(F)(F)F)C)=O)C(C1=CN(N=N1)CC1=CC=C(C=C1)OC)(C)C
SPLASH splash10-00di-0920300000-c94492f69e07b5b94da3
Source of Spectrum QE-21-SM9-2l (DOI: 10.1002/chem.201501134)
Wiley ID 1906635