| SpectraBase Spectrum ID |
17wSMHGgfF5 |
| Name |
5-pyrimidinecarboxylic acid, 4-(5-bromo-2-thienyl)-1,2,3,4-tetrahydro-1,6-dimethyl-2-oxo-, phenylmethyl 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 |
420.014326586 u |
| Formula |
C18H17BrN2O3S |
| InChI |
InChI=1S/C18H17BrN2O3S/c1-11-15(17(22)24-10-12-6-4-3-5-7-12)16(20-18(23)21(11)2)13-8-9-14(19)25-13/h3-9,16H,10H2,1-2H3,(H,20,23) |
| InChIKey |
OWTHXXJMJCRULF-UHFFFAOYSA-N |
| Molecular Weight |
421.309 g/mol |
| NMR Offset |
16.1752 |
| NMR Spectrometer Frequency |
200.133 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_2331 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/9234112; Lab Info: SAS; Lab Number: SAS-TST0932 |
| Temperature |
39.85 °C |
