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1-[2-(1-adamantyloxy)ethyl]-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID 8HHzUd5V2QK
InChI InChI=1S/C27H32FNO5/c1-32-25(30)22-15-29(7-8-34-27-12-17-9-18(13-27)11-19(10-17)14-27)16-23(26(31)33-2)24(22)20-3-5-21(28)6-4-20/h3-6,15-19,24H,7-14H2,1-2H3
InChIKey GVXSPPNGUINJLC-UHFFFAOYSA-N
Mol Weight 469.6 g/mol
Molecular Formula C27H32FNO5
Exact Mass 469.226451 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID 9ldOVv76vC0
Name 3,5-pyridinedicarboxylic acid, 4-(4-fluorophenyl)-1,4-dihydro-1-[2-(tricyclo[3.3.1.1~3,7~]dec-1-yloxy)ethyl]-, dimethyl 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 469.226451292 u
Formula C27H32FNO5
InChI InChI=1S/C27H32FNO5/c1-32-25(30)22-15-29(7-8-34-27-12-17-9-18(13-27)11-19(10-17)14-27)16-23(26(31)33-2)24(22)20-3-5-21(28)6-4-20/h3-6,15-19,24H,7-14H2,1-2H3
InChIKey GVXSPPNGUINJLC-UHFFFAOYSA-N
Molecular Weight 469.553 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15418
Solvent DMSO-d6
Source Vendor ID: NMR/11241300; Lab Info: SAS; Lab Number: SAS-tstz018