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NEOLLAXANUZJFU-UHFFFAOYSA-N

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NEOLLAXANUZJFU-UHFFFAOYSA-N
SpectraBase Compound ID JikDhg7xuSL
InChI InChI=1S/C9H6F12O4/c1-22-9(23-2)3(5(10,11)12,6(13,14)15)24-4(25-9,7(16,17)18)8(19,20)21/h1-2H3
InChIKey NEOLLAXANUZJFU-UHFFFAOYSA-N
Mol Weight 406.12 g/mol
Molecular Formula C9H6F12O4
Exact Mass 406.007447 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FavPVpCh6d1
Name NEOLLAXANUZJFU-UHFFFAOYSA-N
Compound Number 2535
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H6F12O4
InChI InChI=1S/C9H6F12O4/c1-22-9(23-2)3(5(10,11)12,6(13,14)15)24-4(25-9,7(16,17)18)8(19,20)21/h1-2H3
InChIKey NEOLLAXANUZJFU-UHFFFAOYSA-N
Literature Reference Author W.ROBIEN
Literature Reference Citation W.ROBIEN,PRIVATE_COMMUNICATION
Molecular Weight 406.125 g/mol
Sample ID 3861
Solvent CDCl3