SpectraBase Spectrum ID |
Hh6aWOdea6L |
Name |
benzoic acid, 4-(9-cyano-8-(4-ethoxy-3-methoxyphenyl)-7,8-dihydro-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 |
493.167142150 u |
Formula |
C26H27N3O5S |
InChI |
InChI=1S/C26H27N3O5S/c1-4-33-22-11-8-18(12-23(22)32-3)20-13-24(30)29-15-28(16-35-25(29)21(20)14-27)19-9-6-17(7-10-19)26(31)34-5-2/h6-12,20H,4-5,13,15-16H2,1-3H3 |
InChIKey |
LJJDDYKRUDDZRM-UHFFFAOYSA-N |
Molecular Weight |
493.578 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2021_3480 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/13278503 |