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2-amino-1-(4-chlorophenyl)-7,7-dimethyl-4-(1-methyl-1H-pyrazol-4-yl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile

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2-amino-1-(4-chlorophenyl)-7,7-dimethyl-4-(1-methyl-1H-pyrazol-4-yl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
SpectraBase Compound ID Iv1lU3AdJ07
InChI InChI=1S/C22H22ClN5O/c1-22(2)8-17-20(18(29)9-22)19(13-11-26-27(3)12-13)16(10-24)21(25)28(17)15-6-4-14(23)5-7-15/h4-7,11-12,19H,8-9,25H2,1-3H3
InChIKey NDUCRURIETYJAX-UHFFFAOYSA-N
Mol Weight 407.91 g/mol
Molecular Formula C22H22ClN5O
Exact Mass 407.151288 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HksPQkT2cPs
Name 2-amino-1-(4-chlorophenyl)-7,7-dimethyl-4-(1-methyl-1H-pyrazol-4-yl)-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarbonitrile
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/C22H22ClN5O/c1-22(2)8-17-20(18(29)9-22)19(13-11-26-27(3)12-13)16(10-24)21(25)28(17)15-6-4-14(23)5-7-15/h4-7,11-12,19H,8-9,25H2,1-3H3
InChIKey NDUCRURIETYJAX-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UZI_26187_2515
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/9172180; Labnumber: AR-ALD/2710; UZI_ID: UZI-002517
Temperature 308 °C