![1-[4'-(Tert-butyldiphenylsiloxymethyl)-6-methoxy-4,2',6'-tris-(4-methoxybenzyloxy)biphenyl-2-yl]hept-6-en-1-ol](/api/spectrum/GqvpqZe6btW/structure.png?h=300&w=458 "1-[4'-(Tert-butyldiphenylsiloxymethyl)-6-methoxy-4,2',6'-tris-(4-methoxybenzyloxy)biphenyl-2-yl]hept-6-en-1-ol")
| SpectraBase Compound ID | GRaDopRauJ7 |
|---|---|
| InChI | InChI=1S/C61H68O9Si/c1-9-10-11-18-23-54(62)53-38-50(67-40-43-24-30-47(63-5)31-25-43)39-55(66-8)58(53)59-56(68-41-44-26-32-48(64-6)33-27-44)36-46(37-57(59)69-42-45-28-34-49(65-7)35-29-45)60(61(2,3)4)70-71(51-19-14-12-15-20-51)52-21-16-13-17-22-52/h9,12-17,19-22,24-39,54,60,62,71H,1,10-11,18,23,40-42H2,2-8H3 |
| InChIKey | NEGQXIVLFCCQHE-UHFFFAOYSA-N |
| Mol Weight | 973.3 g/mol |
| Molecular Formula | C61H68O9Si |
| Exact Mass | 972.46326 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | GqvpqZe6btW |
|---|---|
| Name | 1-[4'-(Tert-butyldiphenylsiloxymethyl)-6-methoxy-4,2',6'-tris-(4-methoxybenzyloxy)biphenyl-2-yl]hept-6-en-1-ol |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 972.463260296 u |
| Formula | C61H68O9Si |
| InChI | InChI=1S/C61H68O9Si/c1-9-10-11-18-23-54(62)53-38-50(67-40-43-24-30-47(63-5)31-25-43)39-55(66-8)58(53)59-56(68-41-44-26-32-48(64-6)33-27-44)36-46(37-57(59)69-42-45-28-34-49(65-7)35-29-45)60(61(2,3)4)70-71(51-19-14-12-15-20-51)52-21-16-13-17-22-52/h9,12-17,19-22,24-39,54,60,62,71H,1,10-11,18,23,40-42H2,2-8H3 |
| InChIKey | NEGQXIVLFCCQHE-UHFFFAOYSA-N |
| Molecular Weight | 973.291 g/mol |
| SMILES | C=1(C=2C(=CC(=CC2OCC2=CC=C(C=C2)OC)C(O[SiH](C=2C=CC=CC2)C2=CC=CC=C2)C(C)(C)C)OCC=2C=CC(=CC2)OC)C(=CC(=CC1OC)OCC=1C=CC(=CC1)OC)C(O)CCCCC=C |