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WEPNBYLIZHVGLT-UHFFFAOYSA-N

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WEPNBYLIZHVGLT-UHFFFAOYSA-N
SpectraBase Compound ID AuiBnsSpcUr
InChI InChI=1S/C12H6F5N3O/c1-20(12-18-3-2-4-19-12)11(21)5-6(13)8(15)10(17)9(16)7(5)14/h2-4H,1H3
InChIKey WEPNBYLIZHVGLT-UHFFFAOYSA-N
Mol Weight 303.19 g/mol
Molecular Formula C12H6F5N3O
Exact Mass 303.043103 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID C3PH1py8znY
Name WEPNBYLIZHVGLT-UHFFFAOYSA-N
Compound Number CIS-#3
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H6F5N3O
InChI InChI=1S/C12H6F5N3O/c1-20(12-18-3-2-4-19-12)11(21)5-6(13)8(15)10(17)9(16)7(5)14/h2-4H,1H3
InChIKey WEPNBYLIZHVGLT-UHFFFAOYSA-N
Literature Reference Author C.C.FORBES,A.M.BEATTY,B.D.SMITH
Literature Reference Citation ORG.LETTERS,3,3595(2001)
Literature Reference DOI 10.1021/ol016733l
Solvent CDCl3
Source File Reference UWLU33902