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MZXQPIRLUAWEJS-VQTJNVASSA-N
SpectraBase Compound ID 3ayhsrj5CQs
InChI InChI=1S/C24H15F9O2S/c25-22(26,27)20(16-11-5-2-6-12-16)19(15-9-3-1-4-10-15)36(34-20)18-14-8-7-13-17(18)21(35-36,23(28,29)30)24(31,32)33/h1-14,19H/t19-,20+/m0/s1
InChIKey MZXQPIRLUAWEJS-VQTJNVASSA-N
Mol Weight 538.43 g/mol
Molecular Formula C24H15F9O2S
Exact Mass 538.064904 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Azp8j1yKPsp
Name MZXQPIRLUAWEJS-VQTJNVASSA-N
Compound Number (3S,4S)/(3R,4R)-#8B
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C24H15F9O2S
InChI InChI=1S/C24H15F9O2S/c25-22(26,27)20(16-11-5-2-6-12-16)19(15-9-3-1-4-10-15)36(34-20)18-14-8-7-13-17(18)21(35-36,23(28,29)30)24(31,32)33/h1-14,19H/t19-,20+/m0/s1
InChIKey MZXQPIRLUAWEJS-VQTJNVASSA-N
Literature Reference Author T.KAWASHIMA,F.OHNO,R.OKAZAKI,H.IKEDA,S.INAGAKI
Literature Reference Citation J.AM.CHEM.SOC.,118,12455(1996)
Literature Reference DOI 10.1021/ja9629975
Molecular Weight 538.428 g/mol
Sample ID 53588
Solvent CDCl3