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5,7,7(1H)-isoquinolinetricarbonitrile, 6-amino-2,3,8,8a-tetrahydro-2-(1-methylethyl)-8-(4-methylphenyl)-
SpectraBase Compound ID 8UyMnbgdlOQ
InChI InChI=1S/C22H23N5/c1-14(2)27-9-8-17-18(10-23)21(26)22(12-24,13-25)20(19(17)11-27)16-6-4-15(3)5-7-16/h4-8,14,19-20H,9,11,26H2,1-3H3
InChIKey RUBGSNGIOBLHOB-UHFFFAOYSA-N
Mol Weight 357.46 g/mol
Molecular Formula C22H23N5
Exact Mass 357.195346 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 7SnGAiQzHp4
Name 5,7,7(1H)-isoquinolinetricarbonitrile, 6-amino-2,3,8,8a-tetrahydro-2-(1-methylethyl)-8-(4-methylphenyl)-
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/C22H23N5/c1-14(2)27-9-8-17-18(10-23)21(26)22(12-24,13-25)20(19(17)11-27)16-6-4-15(3)5-7-16/h4-8,14,19-20H,9,11,26H2,1-3H3
InChIKey RUBGSNGIOBLHOB-UHFFFAOYSA-N
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_4223
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: 63TSH5.913; IOH_ID: IOH-011226