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ethyl 4-{3-[(2-bromophenoxy)methyl]-4-methoxyphenyl}-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate
SpectraBase Compound ID LNdmmTPnykL
InChI InChI=1S/C27H28BrNO5/c1-4-33-27(31)24-16(2)29-20-9-7-10-21(30)26(20)25(24)17-12-13-22(32-3)18(14-17)15-34-23-11-6-5-8-19(23)28/h5-6,8,11-14,25,29H,4,7,9-10,15H2,1-3H3
InChIKey KMQFJGJDSFMVHI-UHFFFAOYSA-N
Mol Weight 526.43 g/mol
Molecular Formula C27H28BrNO5
Exact Mass 525.115086 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID Ayi54257EGO
Name ethyl 4-{3-[(2-bromophenoxy)methyl]-4-methoxyphenyl}-2-methyl-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/C27H28BrNO5/c1-4-33-27(31)24-16(2)29-20-9-7-10-21(30)26(20)25(24)17-12-13-22(32-3)18(14-17)15-34-23-11-6-5-8-19(23)28/h5-6,8,11-14,25,29H,4,7,9-10,15H2,1-3H3
InChIKey KMQFJGJDSFMVHI-UHFFFAOYSA-N
NMR Offset 16.0772
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Origin 1H_UBI_21270_1394
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: 9311495; UBI_ID: UBI-001395
Temperature 308 °C