![4-(1-adamantyl)-N-(2-methyl-1-{[(3-pyridinylmethyl)amino]carbonyl}propyl)benzamide](/api/spectrum/IeUbMxe7jbT/structure.png?h=300&w=458 "4-(1-adamantyl)-N-(2-methyl-1-{[(3-pyridinylmethyl)amino]carbonyl}propyl)benzamide")
| SpectraBase Compound ID | 35SFRbKilkg |
|---|---|
| InChI | InChI=1S/C28H35N3O2/c1-18(2)25(27(33)30-17-19-4-3-9-29-16-19)31-26(32)23-5-7-24(8-6-23)28-13-20-10-21(14-28)12-22(11-20)15-28/h3-9,16,18,20-22,25H,10-15,17H2,1-2H3,(H,30,33)(H,31,32)/t20-,21+,22-,25?,28- |
| InChIKey | BBYIYPJGMLDLIZ-XSVIHUHNSA-N |
| Mol Weight | 445.6 g/mol |
| Molecular Formula | C28H35N3O2 |
| Exact Mass | 445.272927 g/mol |
1H Nuclear Magnetic Resonance (NMR) Spectrum
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| SpectraBase Spectrum ID | IeUbMxe7jbT |
|---|---|
| Name | 4-(1-adamantyl)-N-(2-methyl-1-{[(3-pyridinylmethyl)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 | 445.272927377 u |
| Formula | C28H35N3O2 |
| InChI | InChI=1S/C28H35N3O2/c1-18(2)25(27(33)30-17-19-4-3-9-29-16-19)31-26(32)23-5-7-24(8-6-23)28-13-20-10-21(14-28)12-22(11-20)15-28/h3-9,16,18,20-22,25H,10-15,17H2,1-2H3,(H,30,33)(H,31,32)/t20-,21+,22-,25?,28- |
| InChIKey | BBYIYPJGMLDLIZ-XSVIHUHNSA-N |
| Molecular Weight | 445.607 g/mol |
| NMR Offset | 18.4068 |
| NMR Spectrometer Frequency | 500.137 |
| Observed nucleus | 1H |
| Sample State | Soluted |
| Sample_ID | 1H_CB_2020_9237 |
| Solvent | DMSO-d6 |
| Source | Vendor ID: NMR/13229071 |