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10H-phenothiazine-10-ethanaminium, beta-oxo-N-(3-pyridinylmethyl)-2-(trifluoromethyl)-, chloride

View entire compound with spectra: 1 NMR

10H-phenothiazine-10-ethanaminium, beta-oxo-N-(3-pyridinylmethyl)-2-(trifluoromethyl)-, chloride
SpectraBase Compound ID CUbuYNjyCgf
InChI InChI=1S/C21H16F3N3OS.ClH/c22-21(23,24)15-7-8-19-17(10-15)27(16-5-1-2-6-18(16)29-19)20(28)13-26-12-14-4-3-9-25-11-14;/h1-11,26H,12-13H2;1H
InChIKey IDZVTFZDWYGIDJ-UHFFFAOYSA-N
Mol Weight 451.9 g/mol
Molecular Formula C21H17ClF3N3OS
Exact Mass 451.073296 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3iDrZ0EUBLd
Name 10H-phenothiazine-10-ethanaminium, beta-oxo-N-(3-pyridinylmethyl)-2-(trifluoromethyl)-, chloride
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 451.073295541 u
Formula C21H17ClF3N3OS
InChI InChI=1S/C21H16F3N3OS.ClH/c22-21(23,24)15-7-8-19-17(10-15)27(16-5-1-2-6-18(16)29-19)20(28)13-26-12-14-4-3-9-25-11-14;/h1-11,26H,12-13H2;1H
InChIKey IDZVTFZDWYGIDJ-UHFFFAOYSA-N
Molecular Weight 451.895 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_13316
Solvent DMSO-d6
Source Vendor ID: NMR/10270365; Lab Info: KTS; Lab Number: KTS-COR0051