![N-[2-(3,4-Dimethoxyphenyl)ethyl] (4S)-4-(t-butyldimethylsilyloxy)-5-(hydroxy)pentanamide](/api/spectrum/BctwDz576e5/structure.png?h=300&w=458 "N-[2-(3,4-Dimethoxyphenyl)ethyl] (4S)-4-(t-butyldimethylsilyloxy)-5-(hydroxy)pentanamide")
| SpectraBase Compound ID | 6ADdrU6y8nS |
|---|---|
| InChI | InChI=1S/C21H37NO5Si/c1-21(2,3)28(6,7)27-17(15-23)9-11-20(24)22-13-12-16-8-10-18(25-4)19(14-16)26-5/h8,10,14,17,23H,9,11-13,15H2,1-7H3,(H,22,24)/t17-/m0/s1 |
| InChIKey | WFHJTIAFUUTBLT-KRWDZBQOSA-N |
| Mol Weight | 411.6 g/mol |
| Molecular Formula | C21H37NO5Si |
| Exact Mass | 411.2441 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BctwDz576e5 |
|---|---|
| Name | N-[2-(3,4-Dimethoxyphenyl)ethyl] (4S)-4-(T-butyldimethylsilyloxy)-5-(hydroxy)pentanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 411.244099825 u |
| Formula | C21H37NO5Si |
| InChI | InChI=1S/C21H37NO5Si/c1-21(2,3)28(6,7)27-17(15-23)9-11-20(24)22-13-12-16-8-10-18(25-4)19(14-16)26-5/h8,10,14,17,23H,9,11-13,15H2,1-7H3,(H,22,24)/t17-/m0/s1 |
| InChIKey | WFHJTIAFUUTBLT-KRWDZBQOSA-N |
| Molecular Weight | 411.614 g/mol |
| SMILES | [C@@](O[Si](C(C)(C)C)(C)C)(CCC(=O)NCCC=1C=C(OC)C(=CC1)OC)(CO)[H] |