| SpectraBase Spectrum ID |
7pzzZcwhKXR |
| Name |
acetic acid, [[4-(1,3-benzodioxol-5-yl)-3-cyano-1,4,5,6,7,8-hexahydro-5-oxo-2-quinolinyl]thio]-, ethyl ester |
| Author |
A.V.Yarkov, IPAC, Russia |
| Copyright |
Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved. |
| InChI |
InChI=1S/C21H20N2O5S/c1-2-26-18(25)10-29-21-13(9-22)19(20-14(23-21)4-3-5-15(20)24)12-6-7-16-17(8-12)28-11-27-16/h6-8,19,23H,2-5,10-11H2,1H3 |
| InChIKey |
YDEMGKAGWIOEME-UHFFFAOYSA-N |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Origin |
1H_CB_3517_2379 |
| Owner |
Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc. |
| Sample State |
soluted |
| Solvent |
DMSO-d6 |
| Source File Reference |
VendorID: NMR/11238715 |
![acetic acid, [[4-(1,3-benzodioxol-5-yl)-3-cyano-1,4,5,6,7,8-hexahydro-5-oxo-2-quinolinyl]thio]-, ethyl ester](/api/spectrum/7pzzZcwhKXR/structure.png?h=300&w=458 "acetic acid, [[4-(1,3-benzodioxol-5-yl)-3-cyano-1,4,5,6,7,8-hexahydro-5-oxo-2-quinolinyl]thio]-, ethyl ester")
