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

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6-amino-2-ethyl-8-(2-methoxyphenyl)-2,3,8,8a-tetrahydro-5,5,7(1H)-isoquinolinetricarbonitrile
SpectraBase Compound ID Av0LY58l7pD
InChI InChI=1S/C21H21N5O/c1-3-26-9-8-17-16(11-26)19(14-6-4-5-7-18(14)27-2)15(10-22)20(25)21(17,12-23)13-24/h4-8,16,19H,3,9,11,25H2,1-2H3
InChIKey JBRHDFRKSIJXIR-UHFFFAOYSA-N
Mol Weight 359.43 g/mol
Molecular Formula C21H21N5O
Exact Mass 359.17461 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID AkYqCO0x11A
Name 6-amino-2-ethyl-8-(2-methoxyphenyl)-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/C21H21N5O/c1-3-26-9-8-17-16(11-26)19(14-6-4-5-7-18(14)27-2)15(10-22)20(25)21(17,12-23)13-24/h4-8,16,19H,3,9,11,25H2,1-2H3
InChIKey JBRHDFRKSIJXIR-UHFFFAOYSA-N
NMR Offset 15.3537
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_16608
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/8147376; UBI_ID: UBI-016611
Temperature 308 °C