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5,7,7(1H)-isoquinolinetricarbonitrile, 6-amino-8-(2,3-dichlorophenyl)-2-ethyl-2,3,8,8a-tetrahydro-, (8S,8aR)-
SpectraBase Compound ID JcSrvK97akP
InChI InChI=1S/C20H17Cl2N5/c1-2-27-7-6-12-14(8-23)19(26)20(10-24,11-25)17(15(12)9-27)13-4-3-5-16(21)18(13)22/h3-6,15,17H,2,7,9,26H2,1H3
InChIKey YSBSLQRCXADTIO-UHFFFAOYSA-N
Mol Weight 398.3 g/mol
Molecular Formula C20H17Cl2N5
Exact Mass 397.086101 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AXx3NtjLsv8
Name 5,7,7(1H)-isoquinolinetricarbonitrile, 6-amino-8-(2,3-dichlorophenyl)-2-ethyl-2,3,8,8a-tetrahydro-, (8S,8aR)-
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/C20H17Cl2N5/c1-2-27-7-6-12-14(8-23)19(26)20(10-24,11-25)17(15(12)9-27)13-4-3-5-16(21)18(13)22/h3-6,15,17H,2,7,9,26H2,1H3
InChIKey YSBSLQRCXADTIO-UHFFFAOYSA-N
NMR Offset 16.4447
NMR Spectrometer Frequency 250.134
Observed nucleus 1H
Origin 1H_ASIOH_8516_6561
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: TSH/5636628; IOH_ID: IOH-013565
Temperature 297 °C