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Dimethyl 2,2,4,4-tetrafluorobicyclo[1.1.1]pentane-1,3-dicarboxylate
SpectraBase Compound ID 6hEv0wMe9ul
InChI InChI=1S/C9H8F4O4/c1-16-4(14)6-3-7(5(15)17-2,8(6,10)11)9(6,12)13/h3H2,1-2H3/t6-,7+
InChIKey LLMIFSZSTUQGNJ-KNVOCYPGSA-N
Mol Weight 256.15 g/mol
Molecular Formula C9H8F4O4
Exact Mass 256.035871 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID K6XHC7rNnmW
Name DIMETHYL-2,2,4,4-TETRAFLUOROBICYCLO-[1.1.1]-PENTANE-1,3-DICARBOXYLATE
Compound Number 4X
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C9H8F4O4
InChI InChI=1S/C9H8F4O4/c1-16-4(14)6-3-7(5(15)17-2,8(6,10)11)9(6,12)13/h3H2,1-2H3/t6-,7+
InChIKey LLMIFSZSTUQGNJ-KNVOCYPGSA-N
Literature Reference Author A.B.SHTAREV,E.PINKHASSIK,M.D.LEVIN,I.STIBOR,J.MICHL
Literature Reference Citation J.AM.CHEM.SOC.,123,3484(2001)
Literature Reference DOI 10.1021/ja0000495
Molecular Weight 256.154 g/mol
Solvent CDCl3
Source File Reference UWLU30521