![urea, N-[3-(4-cyclohexyl-1-piperazinyl)propyl]-N'-[2-(trifluoromethyl)phenyl]-](/api/spectrum/KOahyBMksiV/structure.png?h=300&w=458 "urea, N-[3-(4-cyclohexyl-1-piperazinyl)propyl]-N'-[2-(trifluoromethyl)phenyl]-")
| SpectraBase Compound ID | Evz6pOkDbcP |
|---|---|
| InChI | InChI=1S/C21H31F3N4O/c22-21(23,24)18-9-4-5-10-19(18)26-20(29)25-11-6-12-27-13-15-28(16-14-27)17-7-2-1-3-8-17/h4-5,9-10,17H,1-3,6-8,11-16H2,(H2,25,26,29) |
| InChIKey | YMRPEOFBUIDGHV-UHFFFAOYSA-N |
| Mol Weight | 412.5 g/mol |
| Molecular Formula | C21H31F3N4O |
| Exact Mass | 412.244996 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | KOahyBMksiV |
|---|---|
| Name | urea, N-[3-(4-cyclohexyl-1-piperazinyl)propyl]-N'-[2-(trifluoromethyl)phenyl]- |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 412.244996122 u |
| Formula | C21H31F3N4O |
| InChI | InChI=1S/C21H31F3N4O/c22-21(23,24)18-9-4-5-10-19(18)26-20(29)25-11-6-12-27-13-15-28(16-14-27)17-7-2-1-3-8-17/h4-5,9-10,17H,1-3,6-8,11-16H2,(H2,25,26,29) |
| InChIKey | YMRPEOFBUIDGHV-UHFFFAOYSA-N |
| Molecular Weight | 412.501 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2021_3814 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13279105 |