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ZJHFWJQNKDVJDU-UHFFFAOYSA-M

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ZJHFWJQNKDVJDU-UHFFFAOYSA-M
SpectraBase Compound ID KUf8YwnyLTF
InChI InChI=1S/C18H27FN2O3.CHF3O3S.K/c19-18-16-2-1-3-17(18)15-21-5-9-22-8-4-20(14-16)6-10-23-12-13-24-11-7-21;2-1(3,4)8(5,6)7;/h1-3H,4-15H2;(H,5,6,7);/q;;+1/p-1
InChIKey ZJHFWJQNKDVJDU-UHFFFAOYSA-M
Mol Weight 526.58 g/mol
Molecular Formula C19H27F4KN2O6S
Exact Mass 526.116302 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID H82K5lYjqMc
Name ZJHFWJQNKDVJDU-UHFFFAOYSA-M
Compound Number FN2O3.KSO3CF3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H27F4KN2O6S
InChI InChI=1S/C18H27FN2O3.CHF3O3S.K/c19-18-16-2-1-3-17(18)15-21-5-9-22-8-4-20(14-16)6-10-23-12-13-24-11-7-21;2-1(3,4)8(5,6)7;/h1-3H,4-15H2;(H,5,6,7);/q;;+1/p-1
InChIKey ZJHFWJQNKDVJDU-UHFFFAOYSA-M
Literature Reference Author H.PLENIO,R.DIODONE
Literature Reference Citation J.AM.CHEM.SOC.,118,356(1996)
Literature Reference DOI 10.1021/ja952928a
Molecular Weight 526.585 g/mol
Sample ID 57192
Solvent CD3CN