| SpectraBase Compound ID | 3RRiN0goBUv |
|---|---|
| InChI | InChI=1S/C53H59ClN5O15PSi.C6H15N/c1-52(2,3)76(5,6)74-44-37(30-55-43(62)29-39-45(73-75(66)67)46(72-49(63)36-19-13-14-20-38(36)54)48(70-39)59-28-26-42(61)57-51(59)65)40(71-47(44)58-27-25-41(60)56-50(58)64)31-69-53(32-15-9-7-10-16-32,33-17-11-8-12-18-33)34-21-23-35(68-4)24-22-34;1-4-7(5-2)6-3/h7-28,37,39-40,44-48,75H,29-31H2,1-6H3,(H,55,62)(H,66,67)(H,56,60,64)(H,57,61,65);4-6H2,1-3H3/t37-,39+,40-,44-,45+,46+,47-,48+;/m0./s1 |
| InChIKey | LJOCHDZWIQGYFE-FCAGQYQTSA-N |
| Mol Weight | 1201.78 g/mol |
| Molecular Formula | C59H74ClN6O15PSi |
| Exact Mass | 1200.440757 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | BmGp6vTDlJP |
|---|---|
| Name | LJOCHDZWIQGYFE-FCAGQYQTSA-N |
| Compound Number | 20A |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C59H73ClN6O15PSi |
| InChI | InChI=1S/C53H59ClN5O15PSi.C6H15N/c1-52(2,3)76(5,6)74-44-37(30-55-43(62)29-39-45(73-75(66)67)46(72-49(63)36-19-13-14-20-38(36)54)48(70-39)59-28-26-42(61)57-51(59)65)40(71-47(44)58-27-25-41(60)56-50(58)64)31-69-53(32-15-9-7-10-16-32,33-17-11-8-12-18-33)34-21-23-35(68-4)24-22-34;1-4-7(5-2)6-3/h7-28,37,39-40,44-48,75H,29-31H2,1-6H3,(H,55,62)(H,66,67)(H,56,60,64)(H,57,61,65);4-6H2,1-3H3/t37-,39+,40-,44-,45+,46+,47-,48+;/m0./s1 |
| InChIKey | LJOCHDZWIQGYFE-FCAGQYQTSA-N |
| Literature Reference Author | E.ROZNERS,D.KATKEVICA,E.BIZDENA,R.STROEMBERG |
| Literature Reference Citation | J.AM.CHEM.SOC.,125,12125(2003) |
| Literature Reference DOI | 10.1021/ja0360900 |
| Molecular Weight | 1200.772 g/mol |
| Sample ID | 50613 |
| Solvent | CDCl3:CD3OD=9:1 |