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3-pyridinecarbonitrile, 4-(1,3-benzodioxol-5-yl)-2-(ethylthio)-1,4,5,6-tetrahydro-6-oxo-
SpectraBase Compound ID AEtVPFmiT2M
InChI InChI=1S/C15H14N2O3S/c1-2-21-15-11(7-16)10(6-14(18)17-15)9-3-4-12-13(5-9)20-8-19-12/h3-5,10H,2,6,8H2,1H3,(H,17,18)
InChIKey XWPXQLYTIMPHDA-UHFFFAOYSA-N
Mol Weight 302.35 g/mol
Molecular Formula C15H14N2O3S
Exact Mass 302.072513 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 3BAv0YTbMc0
Name 3-pyridinecarbonitrile, 4-(1,3-benzodioxol-5-yl)-2-(ethylthio)-1,4,5,6-tetrahydro-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/C15H14N2O3S/c1-2-21-15-11(7-16)10(6-14(18)17-15)9-3-4-12-13(5-9)20-8-19-12/h3-5,10H,2,6,8H2,1H3,(H,17,18)
InChIKey XWPXQLYTIMPHDA-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_2267
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/11238572