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JQUYEIWPNSAWMV-ILVIJNOASA-N
SpectraBase Compound ID 36y3DmDc5Fy
InChI InChI=1S/C30H37F3O6/c1-18-11-10-15-27(4)24(39-27)23(34)21-17-22(19(2)26(3,16-14-18)28(21,5)36)38-25(35)29(37-6,30(31,32)33)20-12-8-7-9-13-20/h7-9,11-13,17,19,22,24,36H,10,14-16H2,1-6H3/b18-11-/t19-,22+,24+,26+,27-,28+,29?/m0/s1
InChIKey JQUYEIWPNSAWMV-ILVIJNOASA-N
Mol Weight 550.6 g/mol
Molecular Formula C30H37F3O6
Exact Mass 550.254223 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7LrlnqNhbOO
Name JQUYEIWPNSAWMV-ILVIJNOASA-N
Compound Number 1E
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C30H37F3O6
InChI InChI=1S/C30H37F3O6/c1-18-11-10-15-27(4)24(39-27)23(34)21-17-22(19(2)26(3,16-14-18)28(21,5)36)38-25(35)29(37-6,30(31,32)33)20-12-8-7-9-13-20/h7-9,11-13,17,19,22,24,36H,10,14-16H2,1-6H3/b18-11-/t19-,22+,24+,26+,27-,28+,29?/m0/s1
InChIKey JQUYEIWPNSAWMV-ILVIJNOASA-N
Literature Reference Author M.SUGANO,A.SATO,Y.IIJIMA,K.FURUYA,H.HARUYAMA,K.YODA,T.HATA
Literature Reference Citation J.ORG.CHEM.,59,564(1994)
Literature Reference DOI 10.1021/jo00082a012
Molecular Weight 550.615 g/mol
Solvent CD3OD
Source File Reference UWMZ2119