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PERFLUORO-PHENYL PHENOXYACETATE
SpectraBase Compound ID GXgJp2Anae7
InChI InChI=1S/C14F12O3/c15-1-3(17)7(21)11(8(22)4(1)18)28-13(27)14(25,26)29-12-9(23)5(19)2(16)6(20)10(12)24
InChIKey WSAWJVREQBRQEE-UHFFFAOYSA-N
Mol Weight 444.13 g/mol
Molecular Formula C14F12O3
Exact Mass 443.965582 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 428IHsmZMpp
Name PERFLUORO-PHENYL PHENOXYACETATE
Comments INTERNAL STANDARD - PARA-(CF3)2C6H4 (63.4 FROM CFCL3). SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C14F12O3
InChI InChI=1S/C14F12O3/c15-1-3(17)7(21)11(8(22)4(1)18)28-13(27)14(25,26)29-12-9(23)5(19)2(16)6(20)10(12)24
InChIKey WSAWJVREQBRQEE-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference V.I.SKOBLIKOVA, V.P.SASS, L.F.ARAPOVA, L.E.FAL'BERG, A.E.ERSHOV, S.A.LOPYREVA,L.F.SOKOLOV, S.V.SOKOLOV (1976) Zhurn.Org.Khim.(Russ. Lang.): v.12, N9, 1888-1892.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported