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UIOOWTKODYUOFU-UHFFFAOYSA-N

View entire compound with spectra: 2 NMR

UIOOWTKODYUOFU-UHFFFAOYSA-N
SpectraBase Compound ID JnpHeu58eLd
InChI InChI=1S/C29H13BF15O2.2C8H8O2.3C4H9.Sn/c1-3-6-11(9-7-4-5-8-10(9)46-2)47-30(12-15(31)21(37)27(43)22(38)16(12)32,13-17(33)23(39)28(44)24(40)18(13)34)14-19(35)25(41)29(45)26(42)20(14)36;2*1-10-8-5-3-2-4-7(8)6-9;3*1-3-4-2;/h3-5,7-8,11H,1,6H2,2H3;2*2-6H,1H3;3*1,3-4H2,2H3;/q-1;;;;;;+1
InChIKey UIOOWTKODYUOFU-UHFFFAOYSA-N
Mol Weight 1251.6 g/mol
Molecular Formula C57H56BF15O6Sn
Exact Mass 1252.295244 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Lgq0zyB2kBI
Name UIOOWTKODYUOFU-UHFFFAOYSA-N
Compound Number O,O-4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C57H56BF15O6Sn
InChI InChI=1S/C29H13BF15O2.2C8H8O2.3C4H9.Sn/c1-3-6-11(9-7-4-5-8-10(9)46-2)47-30(12-15(31)21(37)27(43)22(38)16(12)32,13-17(33)23(39)28(44)24(40)18(13)34)14-19(35)25(41)29(45)26(42)20(14)36;2*1-10-8-5-3-2-4-7(8)6-9;3*1-3-4-2;/h3-5,7-8,11H,1,6H2,2H3;2*2-6H,1H3;3*1,3-4H2,2H3;/q-1;;;;;;+1
InChIKey UIOOWTKODYUOFU-UHFFFAOYSA-N
Literature Reference Author J.M.BLACKWELL,W.E.PIERS,R.MCDONALD
Literature Reference Citation J.AM.CHEM.SOC.,124,1295(2002)
Literature Reference DOI 10.1021/ja012028w
Molecular Weight 1251.544 g/mol
Sample ID 47728
Solvent CD2Cl2