SpectraBase Spectrum ID |
8LQ2rcLPYfw |
Name |
benzoic acid, 4-(9-cyano-7,8-dihydro-8-(2-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)16-8-10-17(11-9-16)26-14-27-22(28)12-19(20(13-25)23(27)32-15-26)18-6-4-5-7-21(18)30-2/h4-11,19H,3,12,14-15H2,1-2H3 |
InChIKey |
BURJJGKSQQAVNI-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_9269 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/14228063 |