![4-(1-adamantyl)-N-[2-methyl-1-({[3-(2-methyl-1-piperidinyl)propyl]amino}carbonyl)propyl]benzamide](/api/spectrum/BI5HBChuTss/structure.png?h=300&w=458 "4-(1-adamantyl)-N-[2-methyl-1-({[3-(2-methyl-1-piperidinyl)propyl]amino}carbonyl)propyl]benzamide")
| SpectraBase Compound ID | DRVypQarAMo |
|---|---|
| InChI | InChI=1S/C31H47N3O2/c1-21(2)28(30(36)32-12-6-14-34-13-5-4-7-22(34)3)33-29(35)26-8-10-27(11-9-26)31-18-23-15-24(19-31)17-25(16-23)20-31/h8-11,21-25,28H,4-7,12-20H2,1-3H3,(H,32,36)(H,33,35)/t22?,23-,24+,25-,28?,31- |
| InChIKey | ZWUOJRFJVADCIJ-GWLKPENESA-N |
| Mol Weight | 493.7 g/mol |
| Molecular Formula | C31H47N3O2 |
| Exact Mass | 493.366828 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | BI5HBChuTss |
|---|---|
| Name | 4-(1-adamantyl)-N-[2-methyl-1-({[3-(2-methyl-1-piperidinyl)propyl]amino}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 | 493.366827763 u |
| Formula | C31H47N3O2 |
| InChI | InChI=1S/C31H47N3O2/c1-21(2)28(30(36)32-12-6-14-34-13-5-4-7-22(34)3)33-29(35)26-8-10-27(11-9-26)31-18-23-15-24(19-31)17-25(16-23)20-31/h8-11,21-25,28H,4-7,12-20H2,1-3H3,(H,32,36)(H,33,35)/t22?,23-,24+,25-,28?,31- |
| InChIKey | ZWUOJRFJVADCIJ-GWLKPENESA-N |
| Molecular Weight | 493.736 g/mol |
| NMR Offset | 18.4065 |
| NMR Spectrometer Frequency | 500.137 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_9221 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13229028 |