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4-isoquinolinecarbonitrile, 5,6,7,8-tetrahydro-3-(methylthio)-1-(1-piperidinyl)-
SpectraBase Compound ID CerKxS7xZ3z
InChI InChI=1S/C16H21N3S/c1-20-16-14(11-17)12-7-3-4-8-13(12)15(18-16)19-9-5-2-6-10-19/h2-10H2,1H3
InChIKey IWCQGSZKMCYXLD-UHFFFAOYSA-N
Mol Weight 287.43 g/mol
Molecular Formula C16H21N3S
Exact Mass 287.145619 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 6l8nZBeSQkG
Name 4-isoquinolinecarbonitrile, 5,6,7,8-tetrahydro-3-(methylthio)-1-(1-piperidinyl)-
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/C16H21N3S/c1-20-16-14(11-17)12-7-3-4-8-13(12)15(18-16)19-9-5-2-6-10-19/h2-10H2,1H3
InChIKey IWCQGSZKMCYXLD-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB_3517_96
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/10318351