![N-[2-(3,4-Dimethoxyphenyl)ethyl] (4S)-4-(t-butyldimethylsilyloxy)-5-(4-methoxybenzyloxy)pentanamide](/api/spectrum/GmgS3xEvJ96/structure.png?h=300&w=458 "N-[2-(3,4-Dimethoxyphenyl)ethyl] (4S)-4-(t-butyldimethylsilyloxy)-5-(4-methoxybenzyloxy)pentanamide")
| SpectraBase Compound ID | 1tPHfoff3mz |
|---|---|
| InChI | InChI=1S/C29H45NO6Si/c1-29(2,3)37(7,8)36-25(21-35-20-23-9-12-24(32-4)13-10-23)14-16-28(31)30-18-17-22-11-15-26(33-5)27(19-22)34-6/h9-13,15,19,25H,14,16-18,20-21H2,1-8H3,(H,30,31)/t25-/m0/s1 |
| InChIKey | OZMYQDQHWOYZQY-VWLOTQADSA-N |
| Mol Weight | 531.8 g/mol |
| Molecular Formula | C29H45NO6Si |
| Exact Mass | 531.301615 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GmgS3xEvJ96 |
|---|---|
| Name | N-[2-(3,4-Dimethoxyphenyl)ethyl] (4S)-4-(T-butyldimethylsilyloxy)-5-(4-methoxybenzyloxy)pentanamide |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 531.301614702 u |
| Formula | C29H45NO6Si |
| InChI | InChI=1S/C29H45NO6Si/c1-29(2,3)37(7,8)36-25(21-35-20-23-9-12-24(32-4)13-10-23)14-16-28(31)30-18-17-22-11-15-26(33-5)27(19-22)34-6/h9-13,15,19,25H,14,16-18,20-21H2,1-8H3,(H,30,31)/t25-/m0/s1 |
| InChIKey | OZMYQDQHWOYZQY-VWLOTQADSA-N |
| Molecular Weight | 531.765 g/mol |
| SMILES | [C@@](O[Si](C(C)(C)C)(C)C)(CCC(=O)NCCC=1C=C(OC)C(=CC1)OC)(COCC1=CC=C(C=C1)OC)[H] |