| SpectraBase Spectrum ID |
IgmXmnic1ej |
| Name |
3H-pyrazol-3-one, 4-[[[2-(4-chlorophenyl)ethyl]amino]methylene]-2-(4-fluorophenyl)-2,4-dihydro-5-propyl-, (4E)- |
| Copyright |
Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
385.135718170 u |
| Formula |
C21H21ClFN3O |
| InChI |
InChI=1S/C21H21ClFN3O/c1-2-3-20-19(14-24-13-12-15-4-6-16(22)7-5-15)21(27)26(25-20)18-10-8-17(23)9-11-18/h4-11,14,24H,2-3,12-13H2,1H3/b19-14+ |
| InChIKey |
AMSKBYOIKZZYDS-XMHGGMMESA-N |
| Molecular Weight |
385.870 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_14717 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11220357; Lab Info: PRE; Lab Number: PRE-s000045 |
![3H-pyrazol-3-one, 4-[[[2-(4-chlorophenyl)ethyl]amino]methylene]-2-(4-fluorophenyl)-2,4-dihydro-5-propyl-, (4E)-](/api/spectrum/IgmXmnic1ej/structure.png?h=300&w=458 "3H-pyrazol-3-one, 4-[[[2-(4-chlorophenyl)ethyl]amino]methylene]-2-(4-fluorophenyl)-2,4-dihydro-5-propyl-, (4E)-")
