![4-(1-adamantyl)-N-(2-methyl-1-{[4-(2-pyridinyl)-1-piperazinyl]carbonyl}propyl)benzamide](/api/spectrum/8MbVfdbHD0d/structure.png?h=300&w=458 "4-(1-adamantyl)-N-(2-methyl-1-{[4-(2-pyridinyl)-1-piperazinyl]carbonyl}propyl)benzamide")
| SpectraBase Compound ID | 4GxMWUPM0Fa |
|---|---|
| InChI | InChI=1S/C31H40N4O2/c1-21(2)28(30(37)35-13-11-34(12-14-35)27-5-3-4-10-32-27)33-29(36)25-6-8-26(9-7-25)31-18-22-15-23(19-31)17-24(16-22)20-31/h3-10,21-24,28H,11-20H2,1-2H3,(H,33,36)/t22-,23+,24-,28?,31- |
| InChIKey | RUUFAZIEMOCAQG-YDHUPCLHSA-N |
| Mol Weight | 500.7 g/mol |
| Molecular Formula | C31H40N4O2 |
| Exact Mass | 500.315127 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | 8MbVfdbHD0d |
|---|---|
| Name | 4-(1-adamantyl)-N-(2-methyl-1-{[4-(2-pyridinyl)-1-piperazinyl]carbonyl}propyl)benzamide |
| Copyright | Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 500.315126542 u |
| Formula | C31H40N4O2 |
| InChI | InChI=1S/C31H40N4O2/c1-21(2)28(30(37)35-13-11-34(12-14-35)27-5-3-4-10-32-27)33-29(36)25-6-8-26(9-7-25)31-18-22-15-23(19-31)17-24(16-22)20-31/h3-10,21-24,28H,11-20H2,1-2H3,(H,33,36)/t22-,23+,24-,28?,31- |
| InChIKey | RUUFAZIEMOCAQG-YDHUPCLHSA-N |
| Molecular Weight | 500.687 g/mol |
| NMR Offset | 18.4066 |
| NMR Spectrometer Frequency | 500.137 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_9213 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13229019 |