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ethyl 4-(3-methoxy-4-{[3-(trifluoromethyl)benzyl]oxy}phenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate

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ethyl 4-(3-methoxy-4-{[3-(trifluoromethyl)benzyl]oxy}phenyl)-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID 9R2LhJgJnQY
InChI InChI=1S/C30H32F3NO5/c1-6-38-28(36)25-17(2)34-21-14-29(3,4)15-22(35)27(21)26(25)19-10-11-23(24(13-19)37-5)39-16-18-8-7-9-20(12-18)30(31,32)33/h7-13,26,34H,6,14-16H2,1-5H3
InChIKey ZGRCGTNOIROAAS-UHFFFAOYSA-N
Mol Weight 543.6 g/mol
Molecular Formula C30H32F3NO5
Exact Mass 543.223258 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID BfgEfCXwS5a
Name ethyl 4-(3-methoxy-4-{[3-(trifluoromethyl)benzyl]oxy}phenyl)-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/C30H32F3NO5/c1-6-38-28(36)25-17(2)34-21-14-29(3,4)15-22(35)27(21)26(25)19-10-11-23(24(13-19)37-5)39-16-18-8-7-9-20(12-18)30(31,32)33/h7-13,26,34H,6,14-16H2,1-5H3
InChIKey ZGRCGTNOIROAAS-UHFFFAOYSA-N
NMR Offset 14.9921
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12626
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/9123847; UBI_ID: UBI-012629
Temperature 313 °C