| SpectraBase Compound ID | 7x36OIDHBBB |
|---|---|
| InChI | InChI=1S/C78H156O30Si6/c1-73(2,3)109(25,26)103-55-49-43(37-79)91-67(61(55)85-19)98-50-44(38-80)93-69(63(87-21)56(50)104-110(27,28)74(4,5)6)100-52-46(40-82)95-71(65(89-23)58(52)106-112(31,32)76(10,11)12)102-54-48(42-84)96-72(66(90-24)60(54)108-114(35,36)78(16,17)18)101-53-47(41-83)94-70(64(88-22)59(53)107-113(33,34)77(13,14)15)99-51-45(39-81)92-68(97-49)62(86-20)57(51)105-111(29,30)75(7,8)9/h43-72,79-84H,37-42H2,1-36H3/t43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55+,56+,57+,58+,59+,60+,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-/m1/s1 |
| InChIKey | XXDPIKAIZYOACP-WLPBKHADSA-N |
| Mol Weight | 1742.6 g/mol |
| Molecular Formula | C78H156O30Si6 |
| Exact Mass | 1740.929703 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | LYDpgjeWUql |
|---|---|
| Name | XXDPIKAIZYOACP-WLPBKHADSA-N |
| Compound Number | 12A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C78H156O30Si6 |
| InChI | InChI=1S/C78H156O30Si6/c1-73(2,3)109(25,26)103-55-49-43(37-79)91-67(61(55)85-19)98-50-44(38-80)93-69(63(87-21)56(50)104-110(27,28)74(4,5)6)100-52-46(40-82)95-71(65(89-23)58(52)106-112(31,32)76(10,11)12)102-54-48(42-84)96-72(66(90-24)60(54)108-114(35,36)78(16,17)18)101-53-47(41-83)94-70(64(88-22)59(53)107-113(33,34)77(13,14)15)99-51-45(39-81)92-68(97-49)62(86-20)57(51)105-111(29,30)75(7,8)9/h43-72,79-84H,37-42H2,1-36H3/t43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-,54-,55+,56+,57+,58+,59+,60+,61-,62-,63-,64-,65-,66-,67-,68-,69-,70-,71-,72-/m1/s1 |
| InChIKey | XXDPIKAIZYOACP-WLPBKHADSA-N |
| Literature Reference Author | J.GU,T.CHEN,P.ZHANG,C.C.LING |
| Literature Reference Citation | EUR.J.ORG.CHEM.,2014,5793(2014) |
| Literature Reference DOI | 10.1002/ejoc.201402802 |
| Molecular Weight | 1742.592 g/mol |
| Solvent | C5D5N |
| Source File Reference | UWLU85359 |