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2-((4-Methoxyphenyl)amino)-3-methyl-2-(trifluoromethyl)butanenitrile
SpectraBase Compound ID 6bWzfxz3m42
InChI InChI=1S/C13H15F3N2O/c1-9(2)12(8-17,13(14,15)16)18-10-4-6-11(19-3)7-5-10/h4-7,9,18H,1-3H3
InChIKey XVFDHBWODNCSEA-UHFFFAOYSA-N
Mol Weight 272.27 g/mol
Molecular Formula C13H15F3N2O
Exact Mass 272.113648 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3SuOYtmJcCX
Name 2-((4-Methoxyphenyl)amino)-3-methyl-2-(trifluoromethyl)butanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15F3N2O
InChI InChI=1S/C13H15F3N2O/c1-9(2)12(8-17,13(14,15)16)18-10-4-6-11(19-3)7-5-10/h4-7,9,18H,1-3H3
InChIKey XVFDHBWODNCSEA-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201000666
Molecular Weight 272.271 g/mol
SMILES N(c1ccc(OC)cc1)C(C(F)(F)F)(C(C)C)C#N
SPLASH splash10-00di-4950000000-34b1e34bdd7d8f2bdb47
Source of Spectrum ASC-352-3147/SM23-2m
Wiley ID 1764217