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3-pyridinecarbonitrile, 2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4,6-diphenyl-
SpectraBase Compound ID CVdUbe9PcWs
InChI InChI=1S/C27H20N2O2S/c1-31-22-14-12-21(13-15-22)26(30)18-32-27-24(17-28)23(19-8-4-2-5-9-19)16-25(29-27)20-10-6-3-7-11-20/h2-16H,18H2,1H3
InChIKey DEZICCZLCIZYLH-UHFFFAOYSA-N
Mol Weight 436.53 g/mol
Molecular Formula C27H20N2O2S
Exact Mass 436.124549 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8MtXXarCK3S
Name 3-pyridinecarbonitrile, 2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4,6-diphenyl-
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 436.124549064 u
Formula C27H20N2O2S
InChI InChI=1S/C27H20N2O2S/c1-31-22-14-12-21(13-15-22)26(30)18-32-27-24(17-28)23(19-8-4-2-5-9-19)16-25(29-27)20-10-6-3-7-11-20/h2-16H,18H2,1H3
InChIKey DEZICCZLCIZYLH-UHFFFAOYSA-N
Molecular Weight 436.529 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_257
Solvent DMSO-d6
Source Vendor ID: NMR/8315041; Lab Info: NVN; Lab Number: NVN-0000129
Temperature 29.85 °C