| SpectraBase Spectrum ID |
4xqnxE2gghD |
| Name |
3,5-pyridinedicarboxylic acid, 1-[(4-chlorophenyl)methyl]-1,4-dihydro-4-[4-(trifluoromethyl)phenyl]-, 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 |
465.095470281 u |
| Formula |
C23H19ClF3NO4 |
| InChI |
InChI=1S/C23H19ClF3NO4/c1-31-21(29)18-12-28(11-14-3-9-17(24)10-4-14)13-19(22(30)32-2)20(18)15-5-7-16(8-6-15)23(25,26)27/h3-10,12-13,20H,11H2,1-2H3 |
| InChIKey |
WQEKBQJMYBBSIF-UHFFFAOYSA-N |
| Molecular Weight |
465.856 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_9571 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10241044; Lab Info: SAS; Lab Number: SAS-tst3625 |
| Temperature |
23.85 °C |
![3,5-pyridinedicarboxylic acid, 1-[(4-chlorophenyl)methyl]-1,4-dihydro-4-[4-(trifluoromethyl)phenyl]-, dimethyl ester](/api/spectrum/4xqnxE2gghD/structure.png?h=300&w=458 "3,5-pyridinedicarboxylic acid, 1-[(4-chlorophenyl)methyl]-1,4-dihydro-4-[4-(trifluoromethyl)phenyl]-, dimethyl ester")
