| SpectraBase Spectrum ID |
B21IYS2H7jW |
| Name |
benzoic acid, 4-[3-(3-chloro-4-fluorophenyl)-1,2,3,4-tetrahydro-4-oxo-2-quinazolinyl]-, 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 |
410.083348243 u |
| Formula |
C22H16ClFN2O3 |
| InChI |
InChI=1S/C22H16ClFN2O3/c1-29-22(28)14-8-6-13(7-9-14)20-25-19-5-3-2-4-16(19)21(27)26(20)15-10-11-18(24)17(23)12-15/h2-12,20,25H,1H3 |
| InChIKey |
JIWZGOTUDOGKGI-UHFFFAOYSA-N |
| Molecular Weight |
410.832 g/mol |
| NMR Offset |
18.0059 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_167 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: ZI/8048878; Lab Info: LD; Lab Number: LD-C002106 |
| Temperature |
29.85 °C |
![benzoic acid, 4-[3-(3-chloro-4-fluorophenyl)-1,2,3,4-tetrahydro-4-oxo-2-quinazolinyl]-, methyl ester](/api/spectrum/B21IYS2H7jW/structure.png?h=300&w=458 "benzoic acid, 4-[3-(3-chloro-4-fluorophenyl)-1,2,3,4-tetrahydro-4-oxo-2-quinazolinyl]-, methyl ester")
