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3-pyridinecarbonitrile, 2-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]thio]-6-phenyl-4-(trifluoromethyl)-
SpectraBase Compound ID EMK9MFPPI8x
InChI InChI=1S/C27H16F3N3OS2/c28-27(29,30)19-14-20(17-8-2-1-3-9-17)32-26(18(19)15-31)35-16-25(34)33-21-10-4-6-12-23(21)36-24-13-7-5-11-22(24)33/h1-14H,16H2
InChIKey MFEMGTBZQQHUDY-UHFFFAOYSA-N
Mol Weight 519.56 g/mol
Molecular Formula C27H16F3N3OS2
Exact Mass 519.068689 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 2de84kq4OYx
Name 3-pyridinecarbonitrile, 2-[[2-oxo-2-(10H-phenothiazin-10-yl)ethyl]thio]-6-phenyl-4-(trifluoromethyl)-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 519.068688983 u
Formula C27H16F3N3OS2
InChI InChI=1S/C27H16F3N3OS2/c28-27(29,30)19-14-20(17-8-2-1-3-9-17)32-26(18(19)15-31)35-16-25(34)33-21-10-4-6-12-23(21)36-24-13-7-5-11-22(24)33/h1-14H,16H2
InChIKey MFEMGTBZQQHUDY-UHFFFAOYSA-N
Molecular Weight 519.560 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_6731
Solvent DMSO-d6
Source Vendor ID: NMR/10220337; Lab Info: FNG; Lab Number: FNG-0000012