| SpectraBase Spectrum ID |
AvY1XSSBmKH |
| Name |
3-pyridinecarboxylic acid, 4-(2-bromophenyl)-1,4,5,6-tetrahydro-2-methyl-6-oxo-, methyl 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 |
323.015706312 u |
| Formula |
C14H14BrNO3 |
| InChI |
InChI=1S/C14H14BrNO3/c1-8-13(14(18)19-2)10(7-12(17)16-8)9-5-3-4-6-11(9)15/h3-6,10H,7H2,1-2H3,(H,16,17) |
| InChIKey |
VDAQHVVUIKHWEP-UHFFFAOYSA-N |
| Molecular Weight |
324.174 g/mol |
| NMR Offset |
16.1752 |
| NMR Spectrometer Frequency |
200.133 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_8024 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9243052; Lab Info: SAS; Lab Number: SAS-TST0955 |
| Temperature |
39.85 °C |
