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3-amino-2-methyl-1-thioxo-1,2,5,6,7,8-hexahydro-4-isoquinolinecarbonitrile
SpectraBase Compound ID LswAm3GjRpC
InChI InChI=1S/C11H13N3S/c1-14-10(13)9(6-12)7-4-2-3-5-8(7)11(14)15/h2-5,13H2,1H3
InChIKey IKKYLYMSTJZDRD-UHFFFAOYSA-N
Mol Weight 219.31 g/mol
Molecular Formula C11H13N3S
Exact Mass 219.083019 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8uYDA2fq75D
Name 3-amino-2-methyl-1-thioxo-1,2,5,6,7,8-hexahydro-4-isoquinolinecarbonitrile
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/C11H13N3S/c1-14-10(13)9(6-12)7-4-2-3-5-8(7)11(14)15/h2-5,13H2,1H3
InChIKey IKKYLYMSTJZDRD-UHFFFAOYSA-N
NMR Offset 15.5012
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_919
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: UZI/6220521; UBI_ID: UBI-000920
Temperature 315 °C