| SpectraBase Spectrum ID |
3D8KW82sNrj |
| Name |
3-pyridinecarboxylic acid, 4-(3,4-dichlorophenyl)-1,4,5,6-tetrahydro-2-methyl-6-oxo-, cyclooctyl 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 |
409.121149066 u |
| Formula |
C21H25Cl2NO3 |
| InChI |
InChI=1S/C21H25Cl2NO3/c1-13-20(21(26)27-15-7-5-3-2-4-6-8-15)16(12-19(25)24-13)14-9-10-17(22)18(23)11-14/h9-11,15-16H,2-8,12H2,1H3,(H,24,25) |
| InChIKey |
RWNJUEYZIKYSEY-UHFFFAOYSA-N |
| Molecular Weight |
410.341 g/mol |
| NMR Offset |
16.1752 |
| NMR Spectrometer Frequency |
200.133 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_2762 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9243056; Lab Info: SAS; Lab Number: SAS-TST0959 |
| Temperature |
39.85 °C |
