| SpectraBase Spectrum ID |
CyXeuIgVOxt |
| Name |
benzoic acid, 4-(9-cyano-7,8-dihydro-6-oxo-8-phenyl-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 |
419.130362719 u |
| Formula |
C23H21N3O3S |
| InChI |
InChI=1S/C23H21N3O3S/c1-2-29-23(28)17-8-10-18(11-9-17)25-14-26-21(27)12-19(16-6-4-3-5-7-16)20(13-24)22(26)30-15-25/h3-11,19H,2,12,14-15H2,1H3 |
| InChIKey |
UPQLMILMUFCROP-UHFFFAOYSA-N |
| Molecular Weight |
419.499 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2021_3513 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/13278536 |
![benzoic acid, 4-(9-cyano-7,8-dihydro-6-oxo-8-phenyl-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)-, ethyl ester](/api/spectrum/CyXeuIgVOxt/structure.png?h=300&w=458 "benzoic acid, 4-(9-cyano-7,8-dihydro-6-oxo-8-phenyl-2H,6H-pyrido[2,1-b][1,3,5]thiadiazin-3(4H)-yl)-, ethyl ester")
