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6-amino-8-(2-chlorophenyl)-2-methyl-2,3,8,8a-tetrahydro-5,5,7(1H)-isoquinolinetricarbonitrile

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6-amino-8-(2-chlorophenyl)-2-methyl-2,3,8,8a-tetrahydro-5,5,7(1H)-isoquinolinetricarbonitrile
SpectraBase Compound ID 3eBpibIi9Z5
InChI InChI=1S/C19H16ClN5/c1-25-7-6-15-14(9-25)17(12-4-2-3-5-16(12)20)13(8-21)18(24)19(15,10-22)11-23/h2-6,14,17H,7,9,24H2,1H3
InChIKey PJKGAOPDWIODDM-UHFFFAOYSA-N
Mol Weight 349.83 g/mol
Molecular Formula C19H16ClN5
Exact Mass 349.109423 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 4nqFDmfxbmK
Name 6-amino-8-(2-chlorophenyl)-2-methyl-2,3,8,8a-tetrahydro-5,5,7(1H)-isoquinolinetricarbonitrile
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/C19H16ClN5/c1-25-7-6-15-14(9-25)17(12-4-2-3-5-16(12)20)13(8-21)18(24)19(15,10-22)11-23/h2-6,14,17H,7,9,24H2,1H3
InChIKey PJKGAOPDWIODDM-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16507
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/8126995; UBI_ID: UBI-016510
Temperature 308 °C