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ethyl 4-[1-(2,4-dichlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID GKTmBmsWiko
InChI InChI=1S/C31H31Cl2N3O3/c1-5-39-30(38)26-18(2)34-24-14-31(3,4)15-25(37)28(24)27(26)22-17-36(16-20-11-12-21(32)13-23(20)33)35-29(22)19-9-7-6-8-10-19/h6-13,17,27,34H,5,14-16H2,1-4H3
InChIKey WGCGFJBJVVMPGW-UHFFFAOYSA-N
Mol Weight 564.51 g/mol
Molecular Formula C31H31Cl2N3O3
Exact Mass 563.174247 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HZc9KULFmdn
Name ethyl 4-[1-(2,4-dichlorobenzyl)-3-phenyl-1H-pyrazol-4-yl]-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
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/C31H31Cl2N3O3/c1-5-39-30(38)26-18(2)34-24-14-31(3,4)15-25(37)28(24)27(26)22-17-36(16-20-11-12-21(32)13-23(20)33)35-29(22)19-9-7-6-8-10-19/h6-13,17,27,34H,5,14-16H2,1-4H3
InChIKey WGCGFJBJVVMPGW-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12657
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/9124098; UBI_ID: UBI-012660
Temperature 313 °C