| SpectraBase Compound ID | F5S8L44qmlr |
|---|---|
| InChI | InChI=1S/C61H63N5O15SSi/c1-40(67)78-53-47(48(79-56(53)66-35-31-51(68)64-60(66)73)32-36-77-83(61(2,3)4,44-26-16-8-17-27-44)45-28-18-9-19-29-45)39-82(74,75)37-33-49-46(38-76-57(70)42-22-12-6-13-23-42)52(81-58(71)43-24-14-7-15-25-43)55(80-49)65-34-30-50(63-59(65)72)62-54(69)41-20-10-5-11-21-41/h5-31,34-35,46-49,52-53,55-56H,32-33,36-39H2,1-4H3,(H,64,68,73)(H,62,63,69,72)/t46-,47+,48+,49-,52-,53+,55-,56+/m0/s1 |
| InChIKey | VAOLVMQGCROLHC-WVYILNEJSA-N |
| Mol Weight | 1166.3 g/mol |
| Molecular Formula | C61H63N5O15SSi |
| Exact Mass | 1165.381064 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | CK6RLqxtbcO |
|---|---|
| Name | VAOLVMQGCROLHC-WVYILNEJSA-N |
| Compound Number | 32 |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C61H63N5O15SSi |
| InChI | InChI=1S/C61H63N5O15SSi/c1-40(67)78-53-47(48(79-56(53)66-35-31-51(68)64-60(66)73)32-36-77-83(61(2,3)4,44-26-16-8-17-27-44)45-28-18-9-19-29-45)39-82(74,75)37-33-49-46(38-76-57(70)42-22-12-6-13-23-42)52(81-58(71)43-24-14-7-15-25-43)55(80-49)65-34-30-50(63-59(65)72)62-54(69)41-20-10-5-11-21-41/h5-31,34-35,46-49,52-53,55-56H,32-33,36-39H2,1-4H3,(H,64,68,73)(H,62,63,69,72)/t46-,47+,48+,49-,52-,53+,55-,56+/m0/s1 |
| InChIKey | VAOLVMQGCROLHC-WVYILNEJSA-N |
| Literature Reference Author | C.RICHERT,A.L.ROUGHTON,S.A.BENNER |
| Literature Reference Citation | J.AM.CHEM.SOC.,118,4518(1996) |
| Literature Reference DOI | 10.1021/ja952322m |
| Molecular Weight | 1166.341 g/mol |
| Sample ID | 57102 |
| Solvent | CDCl3 |