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3-pyridinecarbonitrile, 4-(1,3-benzodioxol-5-yl)-1,4,5,6-tetrahydro-2-(methylthio)-6-oxo-
SpectraBase Compound ID 9YsEo5XoF94
InChI InChI=1S/C14H12N2O3S/c1-20-14-10(6-15)9(5-13(17)16-14)8-2-3-11-12(4-8)19-7-18-11/h2-4,9H,5,7H2,1H3,(H,16,17)
InChIKey OVMVZYKMGMJVOY-UHFFFAOYSA-N
Mol Weight 288.32 g/mol
Molecular Formula C14H12N2O3S
Exact Mass 288.056863 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4Ga4tUFynyG
Name 3-pyridinecarbonitrile, 4-(1,3-benzodioxol-5-yl)-1,4,5,6-tetrahydro-2-(methylthio)-6-oxo-
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/C14H12N2O3S/c1-20-14-10(6-15)9(5-13(17)16-14)8-2-3-11-12(4-8)19-7-18-11/h2-4,9H,5,7H2,1H3,(H,16,17)
InChIKey OVMVZYKMGMJVOY-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2281
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/11238588