![1H-isoindole-4-carboxamide, N-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-2-cyclohexyl-2,3-dihydro-3-oxo-](/api/spectrum/2TEEU1eLNz9/structure.png?h=300&w=458 "1H-isoindole-4-carboxamide, N-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-2-cyclohexyl-2,3-dihydro-3-oxo-")
| SpectraBase Compound ID | 9waFQdxL7JJ |
|---|---|
| InChI | InChI=1S/C28H35ClN4O2/c29-22-8-5-11-24(19-22)32-17-15-31(16-18-32)14-6-13-30-27(34)25-12-4-7-21-20-33(28(35)26(21)25)23-9-2-1-3-10-23/h4-5,7-8,11-12,19,23H,1-3,6,9-10,13-18,20H2,(H,30,34) |
| InChIKey | CQMLNWHUJSMNLH-UHFFFAOYSA-N |
| Mol Weight | 495.1 g/mol |
| Molecular Formula | C28H35ClN4O2 |
| Exact Mass | 494.244854 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 2TEEU1eLNz9 |
|---|---|
| Name | 1H-isoindole-4-carboxamide, N-[3-[4-(3-chlorophenyl)-1-piperazinyl]propyl]-2-cyclohexyl-2,3-dihydro-3-oxo- |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 494.244854081 u |
| Formula | C28H35ClN4O2 |
| InChI | InChI=1S/C28H35ClN4O2/c29-22-8-5-11-24(19-22)32-17-15-31(16-18-32)14-6-13-30-27(34)25-12-4-7-21-20-33(28(35)26(21)25)23-9-2-1-3-10-23/h4-5,7-8,11-12,19,23H,1-3,6,9-10,13-18,20H2,(H,30,34) |
| InChIKey | CQMLNWHUJSMNLH-UHFFFAOYSA-N |
| Molecular Weight | 495.067 g/mol |
| NMR Offset | 18.0068 |
| NMR Spectrometer Frequency | 500.134 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2021_5957 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/12709398 |