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4-(3-(4-(Trifluoromethyl)phenyl)-10H-phenothiazin-10-yl)benzonitrile
SpectraBase Compound ID UmJgn0lIEq
InChI InChI=1S/C26H15F3N2S/c27-26(28,29)20-10-7-18(8-11-20)19-9-14-23-25(15-19)32-24-4-2-1-3-22(24)31(23)21-12-5-17(16-30)6-13-21/h1-15H
InChIKey DEXCYLFMHKFKQN-UHFFFAOYSA-N
Mol Weight 444.48 g/mol
Molecular Formula C26H15F3N2S
Exact Mass 444.090804 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BiUYcceeufn
Name 4-(3-(4-(Trifluoromethyl)phenyl)-10H-phenothiazin-10-yl)benzonitrile
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H15F3N2S
InChI InChI=1S/C26H15F3N2S/c27-26(28,29)20-10-7-18(8-11-20)19-9-14-23-25(15-19)32-24-4-2-1-3-22(24)31(23)21-12-5-17(16-30)6-13-21/h1-15H
InChIKey DEXCYLFMHKFKQN-UHFFFAOYSA-N
Instrument Name Finnigan MAT TSQ 7000
Ionization Type EI
Literature Reference DOI 10.1002/chem.202003837
Molecular Weight 444.475 g/mol
SMILES c12ccccc2N(c2ccc(cc2)C#N)c2ccc(-c3ccc(C(F)(F)F)cc3)cc2S1
SPLASH splash10-0006-0212900000-03e38181c0b240edffd2
Source of Spectrum QE-26-SM13-4i
Wiley ID 1841209