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3-pyridinecarboxylic acid, 4-(2-bromophenyl)-1,4,5,6-tetrahydro-2-methyl-6-oxo-, 1-methylpropyl ester
SpectraBase Compound ID 3uUCJCKWfE5
InChI InChI=1S/C17H20BrNO3/c1-4-10(2)22-17(21)16-11(3)19-15(20)9-13(16)12-7-5-6-8-14(12)18/h5-8,10,13H,4,9H2,1-3H3,(H,19,20)
InChIKey DQGFGTYOUVSKNK-UHFFFAOYSA-N
Mol Weight 366.26 g/mol
Molecular Formula C17H20BrNO3
Exact Mass 365.062657 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 5D7lMytPPUm
Name 3-pyridinecarboxylic acid, 4-(2-bromophenyl)-1,4,5,6-tetrahydro-2-methyl-6-oxo-, 1-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 365.062656505 u
Formula C17H20BrNO3
InChI InChI=1S/C17H20BrNO3/c1-4-10(2)22-17(21)16-11(3)19-15(20)9-13(16)12-7-5-6-8-14(12)18/h5-8,10,13H,4,9H2,1-3H3,(H,19,20)
InChIKey DQGFGTYOUVSKNK-UHFFFAOYSA-N
Molecular Weight 366.255 g/mol
NMR Offset 18.0059
NMR Spectrometer Frequency 300.135
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_648
Solvent DMSO-d6
Source Vendor ID: NMR/8265185; Lab Info: SAS; Lab Number: SAS-TST0000012
Temperature 29.85 °C