![7-(1'-Benzyl-1H-indol-3'-yl)-3-[(t-butyldimethylsilyl)oxy]-5-heptenoic acid](/api/spectrum/D8ntkejsra0/structure.png?h=300&w=458 "7-(1'-Benzyl-1H-indol-3'-yl)-3-[(t-butyldimethylsilyl)oxy]-5-heptenoic acid")
| SpectraBase Compound ID | KPhHoHfyhgh |
|---|---|
| InChI | InChI=1S/C28H37NO3Si/c1-28(2,3)33(4,5)32-24(19-27(30)31)16-10-9-15-23-21-29(20-22-13-7-6-8-14-22)26-18-12-11-17-25(23)26/h6-14,17-18,21,24H,15-16,19-20H2,1-5H3,(H,30,31)/b10-9+ |
| InChIKey | ZWPJLMPUVOFBPX-MDZDMXLPSA-N |
| Mol Weight | 463.7 g/mol |
| Molecular Formula | C28H37NO3Si |
| Exact Mass | 463.254271 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | D8ntkejsra0 |
|---|---|
| Name | 7-(1'-Benzyl-1H-indol-3'-yl)-3-[(T-butyldimethylsilyl)oxy]-5-heptenoic acid |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 463.254270587 u |
| Formula | C28H37NO3Si |
| InChI | InChI=1S/C28H37NO3Si/c1-28(2,3)33(4,5)32-24(19-27(30)31)16-10-9-15-23-21-29(20-22-13-7-6-8-14-22)26-18-12-11-17-25(23)26/h6-14,17-18,21,24H,15-16,19-20H2,1-5H3,(H,30,31)/b10-9+ |
| InChIKey | ZWPJLMPUVOFBPX-MDZDMXLPSA-N |
| Molecular Weight | 463.693 g/mol |
| SMILES | C=1N(C2=C(C1C\C=C\CC(CC(=O)O)O[Si](C(C)(C)C)(C)C)C=CC=C2)CC=1C=CC=CC1 |