| SpectraBase Spectrum ID |
7izw6tylHBM |
| Name |
1,4-benzenedicarboxylic acid, 2-[[(Z)-[1-(4-fluorophenyl)-1,5-dihydro-5-oxo-3-propyl-4H-pyrazol-4-ylidene]methyl]amino]-, dimethyl ester |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
439.154348978 u |
| Formula |
C23H22FN3O5 |
| InChI |
InChI=1S/C23H22FN3O5/c1-4-5-19-18(21(28)27(26-19)16-9-7-15(24)8-10-16)13-25-20-12-14(22(29)31-2)6-11-17(20)23(30)32-3/h6-13,25H,4-5H2,1-3H3/b18-13- |
| InChIKey |
MFTLCJKAKABOPQ-AQTBWJFISA-N |
| Molecular Weight |
439.443 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_14387 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/10300859; Lab Info: PRE; Lab Number: PRE-P000017 |
![1,4-benzenedicarboxylic acid, 2-[[(Z)-[1-(4-fluorophenyl)-1,5-dihydro-5-oxo-3-propyl-4H-pyrazol-4-ylidene]methyl]amino]-, dimethyl ester](/api/spectrum/7izw6tylHBM/structure.png?h=300&w=458 "1,4-benzenedicarboxylic acid, 2-[[(Z)-[1-(4-fluorophenyl)-1,5-dihydro-5-oxo-3-propyl-4H-pyrazol-4-ylidene]methyl]amino]-, dimethyl ester")
