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OSQLOVDLUQCEGR-FCAGQYQTSA-N
SpectraBase Compound ID Kb5yK15PtNl
InChI InChI=1S/C53H59ClN5O15PSi.C6H15N/c1-52(2,3)76(5,6)74-44-37(29-43(62)55-30-39-45(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 OSQLOVDLUQCEGR-FCAGQYQTSA-N
Mol Weight 1201.78 g/mol
Molecular Formula C59H74ClN6O15PSi
Exact Mass 1200.440757 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EVyzPKRLbQN
Name OSQLOVDLUQCEGR-FCAGQYQTSA-N
Compound Number 17A
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(29-43(62)55-30-39-45(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 OSQLOVDLUQCEGR-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 50611
Solvent CDCl3:CD3OD=9:1