SpectraBase Spectrum ID |
PqpnDdx9kP |
Name |
5-thiazolecarboxylic acid, 2-[(4E)-4-[(2E)-3-[4-(dimethylamino)phenyl]-2-propenylidene]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]-4-methyl-, 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/C22H24N4O3S/c1-6-29-21(28)19-15(3)23-22(30-19)26-20(27)18(14(2)24-26)9-7-8-16-10-12-17(13-11-16)25(4)5/h7-13H,6H2,1-5H3/b8-7+,18-9+ |
InChIKey |
XCJVPHFJKJNQJI-OQUKJUSVSA-N |
NMR Offset |
18.0068 |
NMR Spectrometer Frequency |
500.134 |
Observed nucleus |
1H |
Origin |
1H_CB3_9000_6961 |
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/12228866 |