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3-pyridinecarbonitrile, 2-[[2-(4-methoxyphenyl)-2-oxoethyl]thio]-4,6-dimethyl-
SpectraBase Compound ID 9Sbv7SuOPpN
InChI InChI=1S/C17H16N2O2S/c1-11-8-12(2)19-17(15(11)9-18)22-10-16(20)13-4-6-14(21-3)7-5-13/h4-8H,10H2,1-3H3
InChIKey MDQMWNZWRMOAPL-UHFFFAOYSA-N
Mol Weight 312.39 g/mol
Molecular Formula C17H16N2O2S
Exact Mass 312.093249 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4QxteqAQ1Qo
Name 3-pyridinecarbonitrile, 2-[[2-(4-methoxyphenyl)-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 312.093248935 u
Formula C17H16N2O2S
InChI InChI=1S/C17H16N2O2S/c1-11-8-12(2)19-17(15(11)9-18)22-10-16(20)13-4-6-14(21-3)7-5-13/h4-8H,10H2,1-3H3
InChIKey MDQMWNZWRMOAPL-UHFFFAOYSA-N
Molecular Weight 312.387 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_258
Solvent DMSO-d6
Source Vendor ID: NMR/8315042; Lab Info: NVN; Lab Number: NVN-0000130
Temperature 29.85 °C