| SpectraBase Spectrum ID |
w3DcfsRanv |
| Name |
3H-pyrazol-3-one, 4-[[[(4-chlorophenyl)methyl]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 |
371.120068106 u |
| Formula |
C20H19ClFN3O |
| InChI |
InChI=1S/C20H19ClFN3O/c1-2-3-19-18(13-23-12-14-4-6-15(21)7-5-14)20(26)25(24-19)17-10-8-16(22)9-11-17/h4-11,13,23H,2-3,12H2,1H3/b18-13+ |
| InChIKey |
MDYMNDSDUVKULX-QGOAFFKASA-N |
| Molecular Weight |
371.843 g/mol |
| NMR Offset |
18.0068 |
| NMR Spectrometer Frequency |
500.134 |
| Observed nucleus |
1H |
| Sample State |
Soluted |
| Sample_ID |
1H_CB_2017_14539 |
| Solvent |
DMSO-d6 |
| Source |
Vendor ID: NMR/11220354; Lab Info: PRE; Lab Number: PRE-s000042 |
![3H-pyrazol-3-one, 4-[[[(4-chlorophenyl)methyl]amino]methylene]-2-(4-fluorophenyl)-2,4-dihydro-5-propyl-, (4E)-](/api/spectrum/w3DcfsRanv/structure.png?h=300&w=458 "3H-pyrazol-3-one, 4-[[[(4-chlorophenyl)methyl]amino]methylene]-2-(4-fluorophenyl)-2,4-dihydro-5-propyl-, (4E)-")
