| SpectraBase Spectrum ID |
FQDeUITqP2W |
| Name |
4-{(1E)-3-[2-chloro-5-(trifluoromethyl)anilino]-2-cyano-3-oxo-1-propenyl}phenyl 4-methylbenzenesulfonate |
| 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/C24H16ClF3N2O4S/c1-15-2-9-20(10-3-15)35(32,33)34-19-7-4-16(5-8-19)12-17(14-29)23(31)30-22-13-18(24(26,27)28)6-11-21(22)25/h2-13H,1H3,(H,30,31)/b17-12+ |
| InChIKey |
CXJWTMYFXGMDGB-SFQUDFHCSA-N |
| NMR Offset |
14.9921 |
| NMR Spectrometer Frequency |
300.135 |
| Observed nucleus |
1H |
| Origin |
1H_UBI_21270_9048 |
| 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: 1000074; UBI_ID: UBI-009051 |
| Synonyms |
4-{3-[2-chloro-5-(trifluoromethyl)anilino]-2-cyano-3-oxo-1-propenyl}phenyl 4-methylbenzenesulfonate |
| Temperature |
313 °C |
![4-{(1E)-3-[2-chloro-5-(trifluoromethyl)anilino]-2-cyano-3-oxo-1-propenyl}phenyl 4-methylbenzenesulfonate](/api/spectrum/FQDeUITqP2W/structure.png?h=300&w=458 "4-{(1E)-3-[2-chloro-5-(trifluoromethyl)anilino]-2-cyano-3-oxo-1-propenyl}phenyl 4-methylbenzenesulfonate")
