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3-quinolinecarboxylic acid, 4-[1,1'-biphenyl]-4-yl-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, 2-methylpropyl ester
SpectraBase Compound ID 6BaHnucYbbB
InChI InChI=1S/C27H29NO3/c1-17(2)16-31-27(30)24-18(3)28-22-10-7-11-23(29)26(22)25(24)21-14-12-20(13-15-21)19-8-5-4-6-9-19/h4-6,8-9,12-15,17,25,28H,7,10-11,16H2,1-3H3
InChIKey MIVJTEXBWITYBU-UHFFFAOYSA-N
Mol Weight 415.53 g/mol
Molecular Formula C27H29NO3
Exact Mass 415.214744 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID ERjFt0RD2U8
Name 3-quinolinecarboxylic acid, 4-[1,1'-biphenyl]-4-yl-1,4,5,6,7,8-hexahydro-2-methyl-5-oxo-, 2-methylpropyl ester
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.214743795 u
Formula C27H29NO3
InChI InChI=1S/C27H29NO3/c1-17(2)16-31-27(30)24-18(3)28-22-10-7-11-23(29)26(22)25(24)21-14-12-20(13-15-21)19-8-5-4-6-9-19/h4-6,8-9,12-15,17,25,28H,7,10-11,16H2,1-3H3
InChIKey MIVJTEXBWITYBU-UHFFFAOYSA-N
Molecular Weight 415.533 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_11218
Solvent DMSO-d6
Source Vendor ID: NMR/10251705; Lab Info: SAS; Lab Number: SAS-tst3746
Temperature 29.85 °C