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3-pyridinecarbonitrile, 1,4,5,6-tetrahydro-4-(4-hydroxy-3-methoxyphenyl)-6-oxo-2-[(phenylmethyl)thio]-
SpectraBase Compound ID EiScTlvZtrO
InChI InChI=1S/C20H18N2O3S/c1-25-18-9-14(7-8-17(18)23)15-10-19(24)22-20(16(15)11-21)26-12-13-5-3-2-4-6-13/h2-9,15,23H,10,12H2,1H3,(H,22,24)
InChIKey SDJHOLLCTNPNBC-UHFFFAOYSA-N
Mol Weight 366.44 g/mol
Molecular Formula C20H18N2O3S
Exact Mass 366.103814 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BMxTFftD4bc
Name 3-pyridinecarbonitrile, 1,4,5,6-tetrahydro-4-(4-hydroxy-3-methoxyphenyl)-6-oxo-2-[(phenylmethyl)thio]-
Author A.V.Yarkov, IPAC, Russia
Copyright Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI InChI=1S/C20H18N2O3S/c1-25-18-9-14(7-8-17(18)23)15-10-19(24)22-20(16(15)11-21)26-12-13-5-3-2-4-6-13/h2-9,15,23H,10,12H2,1H3,(H,22,24)
InChIKey SDJHOLLCTNPNBC-UHFFFAOYSA-N
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_CB_8313_2342
Owner Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State soluted
Solvent DMSO-d6
Source File Reference VendorID: NMR/9253223; Labnumber: KR-0000077
Temperature 303 °C