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ethyl 4-{4-[(3-fluorobenzyl)oxy]-3-methoxyphenyl}-2,7,7-trimethyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID EKvVhr5WtYA
InChI InChI=1S/C29H32FNO5/c1-6-35-28(33)25-17(2)31-21-14-29(3,4)15-22(32)27(21)26(25)19-10-11-23(24(13-19)34-5)36-16-18-8-7-9-20(30)12-18/h7-13,26,31H,6,14-16H2,1-5H3
InChIKey VNBAXXXDBVUELI-UHFFFAOYSA-N
Mol Weight 493.6 g/mol
Molecular Formula C29H32FNO5
Exact Mass 493.226451 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 8PvIT6Oci88
Name ethyl 4-{4-[(3-fluorobenzyl)oxy]-3-methoxyphenyl}-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/C29H32FNO5/c1-6-35-28(33)25-17(2)31-21-14-29(3,4)15-22(32)27(21)26(25)19-10-11-23(24(13-19)34-5)36-16-18-8-7-9-20(30)12-18/h7-13,26,31H,6,14-16H2,1-5H3
InChIKey VNBAXXXDBVUELI-UHFFFAOYSA-N
NMR Offset 15.449
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_12670
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/9124179; UBI_ID: UBI-012673
Temperature 308 °C