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2-[2-(2-chloranylphenothiazin-10-yl)-2-oxidanylidene-ethyl]sulfanyl-4,6-dimethyl-pyridine-3-carbonitrile
SpectraBase Compound ID AdSNkk4LNBb
InChI InChI=1S/C22H16ClN3OS2/c1-13-9-14(2)25-22(16(13)11-24)28-12-21(27)26-17-5-3-4-6-19(17)29-20-8-7-15(23)10-18(20)26/h3-10H,12H2,1-2H3
InChIKey GKFBVCFBFCUTNX-UHFFFAOYSA-N
Mol Weight 437.96 g/mol
Molecular Formula C22H16ClN3OS2
Exact Mass 437.042332 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7zpZHLzynax
Name 3-pyridinecarbonitrile, 2-[[2-(2-chloro-10H-phenothiazin-10-yl)-2-oxoethyl]thio]-4,6-dimethyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 437.042332194 u
Formula C22H16ClN3OS2
InChI InChI=1S/C22H16ClN3OS2/c1-13-9-14(2)25-22(16(13)11-24)28-12-21(27)26-17-5-3-4-6-19(17)29-20-8-7-15(23)10-18(20)26/h3-10H,12H2,1-2H3
InChIKey GKFBVCFBFCUTNX-UHFFFAOYSA-N
Molecular Weight 437.963 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_18208
Solvent DMSO-d6
Source Vendor ID: NMR/11240910; Lab Info: NKS; Lab Number: NKS-0104017