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JMWRDIBPLQCDHS-XCOLWIKISA-N

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JMWRDIBPLQCDHS-XCOLWIKISA-N
SpectraBase Compound ID 4LAcdZ7bJD
InChI InChI=1S/2C30H36F3NO8/c2*1-27(2,3)42-26(37)34-23(19-40-25(36)29(38-5,30(31,32)33)22-14-10-7-11-15-22)20-41-28(34,4)17-16-24(35)39-18-21-12-8-6-9-13-21/h2*6-15,23H,16-20H2,1-5H3/t23-,28+,29+;23-,28-,29?/m00/s1
InChIKey JMWRDIBPLQCDHS-XCOLWIKISA-N
Mol Weight 1191.2 g/mol
Molecular Formula C60H72F6N2O16
Exact Mass 1190.478603 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D0m1Kvqrn2L
Name JMWRDIBPLQCDHS-XCOLWIKISA-N
Compound Number 17
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C60H72F6N2O16
InChI InChI=1S/2C30H36F3NO8/c2*1-27(2,3)42-26(37)34-23(19-40-25(36)29(38-5,30(31,32)33)22-14-10-7-11-15-22)20-41-28(34,4)17-16-24(35)39-18-21-12-8-6-9-13-21/h2*6-15,23H,16-20H2,1-5H3/t23-,28+,29+;23-,28-,29?/m00/s1
InChIKey JMWRDIBPLQCDHS-XCOLWIKISA-N
Literature Reference Author A.J.WILLIS,Y.KRISHNAN-GHOSH,S.BALASUBRAMANIAN
Literature Reference Citation J.ORG.CHEM.,67,6646(2002)
Literature Reference DOI 10.1021/jo0203239
Molecular Weight 1191.226 g/mol
Solvent CDCl3
Source File Reference UWMS24951