| SpectraBase Spectrum ID |
1iCCRXkF8yK |
| Name |
1H-indole-1-acetic acid, 3-[(Z)-[1-(3-chlorophenyl)-1,5-dihydro-3-methyl-5-oxo-4H-pyrazol-4-ylidene]methyl]-, ethyl ester |
| Copyright |
Copyright © 2022-2025 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
421.119319213 u |
| Formula |
C23H20ClN3O3 |
| InChI |
InChI=1S/C23H20ClN3O3/c1-3-30-22(28)14-26-13-16(19-9-4-5-10-21(19)26)11-20-15(2)25-27(23(20)29)18-8-6-7-17(24)12-18/h4-13H,3,14H2,1-2H3/b20-11- |
| InChIKey |
INXZLCSADCJNFG-JAIQZWGSSA-N |
| Molecular Weight |
421.884 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_17905 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11220120; Lab Info: SAD; Lab Number: 1952 |
![Ethyl (3-{[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-1H-indol-1-yl)acetate](/api/spectrum/1iCCRXkF8yK/structure.png?h=300&w=458 "Ethyl (3-{[1-(3-chlorophenyl)-3-methyl-5-oxo-1,5-dihydro-4H-pyrazol-4-ylidene]methyl}-1H-indol-1-yl)acetate")
