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3-pyridinecarbonitrile, 2-[[2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-oxoethyl]thio]-
SpectraBase Compound ID CJB3fo1mtho
InChI InChI=1S/C16H17N3OS/c1-4-19-11(2)8-14(12(19)3)15(20)10-21-16-13(9-17)6-5-7-18-16/h5-8H,4,10H2,1-3H3
InChIKey JYXIVLHRSNYJTQ-UHFFFAOYSA-N
Mol Weight 299.39 g/mol
Molecular Formula C16H17N3OS
Exact Mass 299.109233 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Cbl4MrMZSfG
Name 3-pyridinecarbonitrile, 2-[[2-(1-ethyl-2,5-dimethyl-1H-pyrrol-3-yl)-2-oxoethyl]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/C16H17N3OS/c1-4-19-11(2)8-14(12(19)3)15(20)10-21-16-13(9-17)6-5-7-18-16/h5-8H,4,10H2,1-3H3
InChIKey JYXIVLHRSNYJTQ-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_11628_9578
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: F35910; Labnumber: ALEKS1-29830