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3-(3-CHLORO-2-HYDROXYPROPOXY)-PERFLUORO-2-METHYLPENTENE-2
SpectraBase Compound ID BTmgDMvng3F
InChI InChI=1S/C9H6ClF11O2/c10-1-3(22)2-23-5(6(11,12)9(19,20)21)4(7(13,14)15)8(16,17)18/h3,22H,1-2H2
InChIKey YXLLPRKXJZEGOF-UHFFFAOYSA-N
Mol Weight 390.58 g/mol
Molecular Formula C9H6ClF11O2
Exact Mass 389.988067 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JHzeUUW5vSz
Name 3-(3-CHLORO-2-HYDROXYPROPOXY)-PERFLUORO-2-METHYLPENTENE-2
Comments CIS AND TRANS CF3 ARE ASSIGNED EXACTLY. SCALE INVERTED;R-32 (PERKIN-ELMER)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9H6ClF11O2
InChI InChI=1S/C9H6ClF11O2/c10-1-3(22)2-23-5(6(11,12)9(19,20)21)4(7(13,14)15)8(16,17)18/h3,22H,1-2H2
InChIKey YXLLPRKXJZEGOF-UHFFFAOYSA-N
Instrument Name SEE COMMENT
Literature Reference V.F.SNEGIREV, K.N.MAKAROV (1985) Izv.Akad.Nauk SSSR(Russ. Lang.): N9, 2066-2076.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported