SpectraBase Spectrum ID |
XTZOJgY0Ii |
Name |
ethyl 5-cyano-6-{[2-(4-ethylanilino)-2-oxoethyl]sulfanyl}-4-(2-furyl)-2-phenyl-1,4-dihydro-3-pyridinecarboxylate |
Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
513.172227531 u |
Formula |
C29H27N3O4S |
InChI |
InChI=1S/C29H27N3O4S/c1-3-19-12-14-21(15-13-19)31-24(33)18-37-28-22(17-30)25(23-11-8-16-36-23)26(29(34)35-4-2)27(32-28)20-9-6-5-7-10-20/h5-16,25,32H,3-4,18H2,1-2H3,(H,31,33) |
InChIKey |
WXTBHQBTWCUYIJ-UHFFFAOYSA-N |
Molecular Weight |
513.612 g/mol |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Sample State |
Soluted |
Sample_ID |
1H_CB_2020_1710 |
Solvent |
DMSO-d6 |
Source |
Vendor ID: NMR/12278291 |