| SpectraBase Spectrum ID |
BOKZnjkGsZE |
| Name |
benzoic acid, 4-(9-cyano-7,8-dihydro-8-(4-methoxyphenyl)-6-oxo-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)-, ethyl 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 |
449.140927403 u |
| Formula |
C24H23N3O4S |
| InChI |
InChI=1S/C24H23N3O4S/c1-3-31-24(29)17-4-8-18(9-5-17)26-14-27-22(28)12-20(21(13-25)23(27)32-15-26)16-6-10-19(30-2)11-7-16/h4-11,20H,3,12,14-15H2,1-2H3 |
| InChIKey |
QAXQZOJOYIFDJO-UHFFFAOYSA-N |
| Molecular Weight |
449.525 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_3502 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13278525 |
![benzoic acid, 4-(9-cyano-7,8-dihydro-8-(4-methoxyphenyl)-6-oxo-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)-, ethyl ester](/api/spectrum/BOKZnjkGsZE/structure.png?h=300&w=458 "benzoic acid, 4-(9-cyano-7,8-dihydro-8-(4-methoxyphenyl)-6-oxo-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)-, ethyl ester")
