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AUELFLBKTPAZTE-UHFFFAOYSA-M

View entire compound with spectra: 2 NMR

AUELFLBKTPAZTE-UHFFFAOYSA-M
SpectraBase Compound ID 62uP8XBzXex
InChI InChI=1S/C18H28FNO4.ClHO4.Na/c1-16-3-2-4-17(18(16)19)15-20-5-7-21-9-11-23-13-14-24-12-10-22-8-6-20;2-1(3,4)5;/h2-4H,5-15H2,1H3;(H,2,3,4,5);/q;;+1/p-1
InChIKey AUELFLBKTPAZTE-UHFFFAOYSA-M
Mol Weight 463.86 g/mol
Molecular Formula C18H28ClFNNaO8
Exact Mass 463.138517 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JQMvK6Rofl9
Name AUELFLBKTPAZTE-UHFFFAOYSA-M
Compound Number FNO4.NACLO4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H28ClFNNaO8
InChI InChI=1S/C18H28FNO4.ClHO4.Na/c1-16-3-2-4-17(18(16)19)15-20-5-7-21-9-11-23-13-14-24-12-10-22-8-6-20;2-1(3,4)5;/h2-4H,5-15H2,1H3;(H,2,3,4,5);/q;;+1/p-1
InChIKey AUELFLBKTPAZTE-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 463.863 g/mol
Sample ID 57208
Solvent CD3CN