For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

1-(1-adamantylmethyl)-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-(1-adamantylmethyl)-4-(4-fluorophenyl)-4H-pyridine-3,5-dicarboxylic acid dimethyl ester
SpectraBase Compound ID KxmhkeINAjc
InChI InChI=1S/C26H30FNO4/c1-31-24(29)21-13-28(15-26-10-16-7-17(11-26)9-18(8-16)12-26)14-22(25(30)32-2)23(21)19-3-5-20(27)6-4-19/h3-6,13-14,16-18,23H,7-12,15H2,1-2H3
InChIKey KGBQUYAWWDHRJF-UHFFFAOYSA-N
Mol Weight 439.53 g/mol
Molecular Formula C26H30FNO4
Exact Mass 439.215887 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 89SSmSUBQBL
Name 3,5-pyridinedicarboxylic acid, 4-(4-fluorophenyl)-1,4-dihydro-1-(tricyclo[3.3.1.1~3,7~]dec-1-ylmethyl)-, 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 439.215886609 u
Formula C26H30FNO4
InChI InChI=1S/C26H30FNO4/c1-31-24(29)21-13-28(15-26-10-16-7-17(11-26)9-18(8-16)12-26)14-22(25(30)32-2)23(21)19-3-5-20(27)6-4-19/h3-6,13-14,16-18,23H,7-12,15H2,1-2H3
InChIKey KGBQUYAWWDHRJF-UHFFFAOYSA-N
Molecular Weight 439.527 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2017_15407
Solvent DMSO-d6
Source Vendor ID: NMR/11241288; Lab Info: SAS; Lab Number: SAS-tstz006