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2-{[4-cyano-1-(4-methylphenyl)-5,6,7,8-tetrahydro-3-isoquinolinyl]sulfanyl}acetamide
SpectraBase Compound ID 1IADdr8GI5v
InChI InChI=1S/C19H19N3OS/c1-12-6-8-13(9-7-12)18-15-5-3-2-4-14(15)16(10-20)19(22-18)24-11-17(21)23/h6-9H,2-5,11H2,1H3,(H2,21,23)
InChIKey HRFTVDVJYCOLES-UHFFFAOYSA-N
Mol Weight 337.44 g/mol
Molecular Formula C19H19N3OS
Exact Mass 337.124883 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID K8wcm6uak4X
Name 2-{[4-cyano-1-(4-methylphenyl)-5,6,7,8-tetrahydro-3-isoquinolinyl]sulfanyl}acetamide
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/C19H19N3OS/c1-12-6-8-13(9-7-12)18-15-5-3-2-4-14(15)16(10-20)19(22-18)24-11-17(21)23/h6-9H,2-5,11H2,1H3,(H2,21,23)
InChIKey HRFTVDVJYCOLES-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_SBI_36227_7500
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: D29949; Labnumber: SHEL-0075; SBI_ID: SBI-007503
Temperature 308 °C