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acetic acid, [[4-cyano-5,6,7,8-tetrahydro-1-(1-piperidinyl)-3-isoquinolinyl]thio]-, methyl ester
SpectraBase Compound ID 1NAsrbOx08a
InChI InChI=1S/C18H23N3O2S/c1-23-16(22)12-24-18-15(11-19)13-7-3-4-8-14(13)17(20-18)21-9-5-2-6-10-21/h2-10,12H2,1H3
InChIKey GKNOEJHEOCUKOQ-UHFFFAOYSA-N
Mol Weight 345.46 g/mol
Molecular Formula C18H23N3O2S
Exact Mass 345.151098 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID IxhbTa3JNia
Name acetic acid, [[4-cyano-5,6,7,8-tetrahydro-1-(1-piperidinyl)-3-isoquinolinyl]thio]-, methyl ester
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/C18H23N3O2S/c1-23-16(22)12-24-18-15(11-19)13-7-3-4-8-14(13)17(20-18)21-9-5-2-6-10-21/h2-10,12H2,1H3
InChIKey GKNOEJHEOCUKOQ-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_CB3_9000_3652
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/11278003