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GBWQSXWXQMRLLD-VTVSBRCESA-N

View entire compound with spectra: 1 NMR

GBWQSXWXQMRLLD-VTVSBRCESA-N
SpectraBase Compound ID I2Se9Kfbqoq
InChI InChI=1S/C44H8F20N4.C13H10.Os/c45-25-21(26(46)34(54)41(61)33(25)53)17-9-1-2-10(65-9)18(22-27(47)35(55)42(62)36(56)28(22)48)12-5-6-14(67-12)20(24-31(51)39(59)44(64)40(60)32(24)52)16-8-7-15(68-16)19(13-4-3-11(17)66-13)23-29(49)37(57)43(63)38(58)30(23)50;1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;/h1-8H;1-10H;/b17-9+,17-11+,18-10+,18-12+,19-13+,19-15+,20-14+,20-16+;;
InChIKey GBWQSXWXQMRLLD-VTVSBRCESA-N
Mol Weight 1329.0 g/mol
Molecular Formula C57H18F20N4Os
Exact Mass 1330.08269 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HLs60yPznRB
Name GBWQSXWXQMRLLD-VTVSBRCESA-N
Compound Number 2
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C57H18F20N4Os
InChI InChI=1S/C44H8F20N4.C13H10.Os/c45-25-21(26(46)34(54)41(61)33(25)53)17-9-1-2-10(65-9)18(22-27(47)35(55)42(62)36(56)28(22)48)12-5-6-14(67-12)20(24-31(51)39(59)44(64)40(60)32(24)52)16-8-7-15(68-16)19(13-4-3-11(17)66-13)23-29(49)37(57)43(63)38(58)30(23)50;1-3-7-12(8-4-1)11-13-9-5-2-6-10-13;/h1-8H;1-10H;/b17-9+,17-11+,18-10+,18-12+,19-13+,19-15+,20-14+,20-16+;;
InChIKey GBWQSXWXQMRLLD-VTVSBRCESA-N
Literature Reference Author Y.LI,J.S.HUANG,Z.Y.ZHOU,C.M.CHE
Literature Reference Citation J.AM.CHEM.SOC.,123,4843(2001)
Literature Reference DOI 10.1021/ja003184q
Molecular Weight 1328.965 g/mol
Solvent CDCl3
Source File Reference UWVN27891