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(S)-3,3,3-Trifluoro-2-((4-methoxyphenyl)amino)-2-(p-tolyl)propanenitrile
SpectraBase Compound ID 5RjAWJuZD6A
InChI InChI=1S/C17H15F3N2O/c1-12-3-5-13(6-4-12)16(11-21,17(18,19)20)22-14-7-9-15(23-2)10-8-14/h3-10,22H,1-2H3/t16-/m1/s1
InChIKey MTXXWARNVDVVTO-MRXNPFEDSA-N
Mol Weight 320.32 g/mol
Molecular Formula C17H15F3N2O
Exact Mass 320.113648 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2R9HMPCDWHp
Name (S)-3,3,3-Trifluoro-2-((4-methoxyphenyl)amino)-2-(p-tolyl)propanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15F3N2O
InChI InChI=1S/C17H15F3N2O/c1-12-3-5-13(6-4-12)16(11-21,17(18,19)20)22-14-7-9-15(23-2)10-8-14/h3-10,22H,1-2H3/t16-/m1/s1
InChIKey MTXXWARNVDVVTO-MRXNPFEDSA-N
Literature Reference DOI 10.1002/adsc.201000666
Molecular Weight 320.315 g/mol
SMILES N([C@@](C(F)(F)F)(c1ccc(cc1)C)C#N)c1ccc(cc1)OC
SPLASH splash10-00di-0902000000-a8199b24dd87689f186a
Source of Spectrum ASC-352-3147/SM17-2e
Wiley ID 1764209