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(R)-3,3,3-trifluoro-2-(4-fluorophenyl)-2-((4-methoxyphenyl)amino)propanenitrile
SpectraBase Compound ID Kc7T50ZWSC7
InChI InChI=1S/C16H12F4N2O/c1-23-14-8-6-13(7-9-14)22-15(10-21,16(18,19)20)11-2-4-12(17)5-3-11/h2-9,22H,1H3/t15-/m0/s1
InChIKey JQGTYNLNSVHKNQ-HNNXBMFYSA-N
Mol Weight 324.28 g/mol
Molecular Formula C16H12F4N2O
Exact Mass 324.088576 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6WrMFHnBmo2
Name (R)-3,3,3-trifluoro-2-(4-fluorophenyl)-2-((4-methoxyphenyl)amino)propanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12F4N2O
InChI InChI=1S/C16H12F4N2O/c1-23-14-8-6-13(7-9-14)22-15(10-21,16(18,19)20)11-2-4-12(17)5-3-11/h2-9,22H,1H3/t15-/m0/s1
InChIKey JQGTYNLNSVHKNQ-HNNXBMFYSA-N
Literature Reference DOI 10.1021/ol201316z
Molecular Weight 324.279 g/mol
SMILES N([C@@](C(F)(F)F)(C#N)c1ccc(cc1)F)c1ccc(cc1)OC
SPLASH splash10-00di-3900000000-67ce96812db6e8162b36
Source of Spectrum A1-13-3826/SM27-6h
Wiley ID 1753483