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MCNWFYONLRSZSK-MZIGQENKSA-N
SpectraBase Compound ID 4UMv2KChCx1
InChI InChI=1S/C22H28F3NO12/c1-9(27)33-8-15-18(35-11(3)29)16(19(36-12(4)30)20(38-15)37-13(5)31)17-14(34-10(2)28)6-7-26(17)21(32)22(23,24)25/h14-20H,6-8H2,1-5H3/t14-,15+,16+,17-,18-,19+,20-/m0/s1
InChIKey MCNWFYONLRSZSK-MZIGQENKSA-N
Mol Weight 555.46 g/mol
Molecular Formula C22H28F3NO12
Exact Mass 555.15636 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5m8e3Uyb4Ml
Name MCNWFYONLRSZSK-MZIGQENKSA-N
Compound Number 25-ALPHA
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H28F3NO12
InChI InChI=1S/C22H28F3NO12/c1-9(27)33-8-15-18(35-11(3)29)16(19(36-12(4)30)20(38-15)37-13(5)31)17-14(34-10(2)28)6-7-26(17)21(32)22(23,24)25/h14-20H,6-8H2,1-5H3/t14-,15+,16+,17-,18-,19+,20-/m0/s1
InChIKey MCNWFYONLRSZSK-MZIGQENKSA-N
Literature Reference Author F.CARDONA,A.GOTI,A.BRANDI
Literature Reference Citation ORG.LETTERS,5,1475(2003)
Literature Reference DOI 10.1021/ol0342507
Molecular Weight 555.459 g/mol
Sample ID 38202
Solvent CDCl3