| SpectraBase Compound ID | FtkfsTULYLk |
|---|---|
| InChI | InChI=1S/C79H97Cl6N3O26Si2/c1-74(2,3)115(75(4,5)6)100-39-46-51(113-115)50(89)48(87-72(96)78(80,81)82)62(86-46)104-54-56(105-63(90)41-29-19-15-20-30-41)61(108-66(93)44-35-25-18-26-36-44)71(112-58(54)67(94)98-13)109-53-49(88-73(97)79(83,84)85)69(103-47-40-101-116(76(7,8)9,77(10,11)12)114-52(47)53)110-55-57(106-64(91)42-31-21-16-22-32-42)60(107-65(92)43-33-23-17-24-34-43)70(102-45-37-27-28-38-45)111-59(55)68(95)99-14/h15-36,45-62,69-71,86,89H,37-40H2,1-14H3,(H,87,96)(H,88,97)/t46-,47+,48-,49+,50-,51-,52+,53+,54-,55-,56-,57-,58-,59-,60+,61+,62+,69-,70+,71+/m1/s1 |
| InChIKey | RIQOLCIWLPGDNK-MTQCFNAYSA-N |
| Mol Weight | 1773.5 g/mol |
| Molecular Formula | C79H97Cl6N3O26Si2 |
| Exact Mass | 1769.402999 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | MWlex6rn4U |
|---|---|
| Name | RIQOLCIWLPGDNK-MTQCFNAYSA-N |
| Compound Number | 25 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C79H97Cl6N3O26Si2 |
| InChI | InChI=1S/C79H97Cl6N3O26Si2/c1-74(2,3)115(75(4,5)6)100-39-46-51(113-115)50(89)48(87-72(96)78(80,81)82)62(86-46)104-54-56(105-63(90)41-29-19-15-20-30-41)61(108-66(93)44-35-25-18-26-36-44)71(112-58(54)67(94)98-13)109-53-49(88-73(97)79(83,84)85)69(103-47-40-101-116(76(7,8)9,77(10,11)12)114-52(47)53)110-55-57(106-64(91)42-31-21-16-22-32-42)60(107-65(92)43-33-23-17-24-34-43)70(102-45-37-27-28-38-45)111-59(55)68(95)99-14/h15-36,45-62,69-71,86,89H,37-40H2,1-14H3,(H,87,96)(H,88,97)/t46-,47+,48-,49+,50-,51-,52+,53+,54-,55-,56-,57-,58-,59-,60+,61+,62+,69-,70+,71+/m1/s1 |
| InChIKey | RIQOLCIWLPGDNK-MTQCFNAYSA-N |
| Literature Reference Author | A.R.D.JONG,A.G.VOLBEDA,B.HAGEN,H.V.D.ELST,H.S.OVERKLEEFT,G.A .V.D.MAREL |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2013,6644(2013) |
| Literature Reference DOI | 10.1002/ejoc.201301055 |
| Molecular Weight | 1773.533 g/mol |
| Solvent | CDCl3 |
| Source File Reference | UWBT20585 |