SpectraBase Spectrum ID |
2QGOutLbBFW |
Name |
benzoic acid, 3-methyl-4-nitro-, 2-ethoxy-4-[(Z)-(4-oxo-2-thioxo-5-thiazolidinylidene)methyl]phenyl 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/C20H16N2O6S2/c1-3-27-16-9-12(10-17-18(23)21-20(29)30-17)4-7-15(16)28-19(24)13-5-6-14(22(25)26)11(2)8-13/h4-10H,3H2,1-2H3,(H,21,23,29)/b17-10- |
InChIKey |
WABFJNSEFIDWTL-YVLHZVERSA-N |
NMR Offset |
18.0059 |
NMR Spectrometer Frequency |
300.135 |
Observed nucleus |
1H |
Origin |
1H_CB_8313_561 |
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: ZI/6054552; Labnumber: SAD-5005 |
Temperature |
303 °C |