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1-(2-Chloranylphenothiazin-10-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanone

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1-(2-Chloranylphenothiazin-10-yl)-2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-ethanone
SpectraBase Compound ID IWOz5BGCMgR
InChI InChI=1S/C20H16ClN3OS2/c1-12-9-13(2)23-20(22-12)26-11-19(25)24-15-5-3-4-6-17(15)27-18-8-7-14(21)10-16(18)24/h3-10H,11H2,1-2H3
InChIKey POPVJLVVKJLMEK-UHFFFAOYSA-N
Mol Weight 413.94 g/mol
Molecular Formula C20H16ClN3OS2
Exact Mass 413.042332 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Jl4OV4ABjWF
Name 10H-phenothiazine, 2-chloro-10-[[(4,6-dimethyl-2-pyrimidinyl)thio]acetyl]-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 413.042332194 u
Formula C20H16ClN3OS2
InChI InChI=1S/C20H16ClN3OS2/c1-12-9-13(2)23-20(22-12)26-11-19(25)24-15-5-3-4-6-17(15)27-18-8-7-14(21)10-16(18)24/h3-10H,11H2,1-2H3
InChIKey POPVJLVVKJLMEK-UHFFFAOYSA-N
Molecular Weight 413.941 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_17127
Solvent DMSO-d6
Source Vendor ID: NMR/11220287; Lab Info: NKS; Lab Number: NKS-0102003