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1,1,1-TRIFLUORO-2-METHYLTHIO-6-METHYL-2-HEPTEN-4-YNE
SpectraBase Compound ID BHoSnFn8awF
InChI InChI=1S/C10H13F3S/c1-4-14-9(10(11,12)13)7-5-6-8(2)3/h7-8H,4H2,1-3H3/b9-7-
InChIKey LIGOYHHCLUMLMX-CLFYSBASSA-N
Mol Weight 222.27 g/mol
Molecular Formula C10H13F3S
Exact Mass 222.069006 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 34t03pKm3aq
Name 1,1,1-TRIFLUORO-2-METHYLTHIO-6-METHYL-2-HEPTEN-4-YNE
Comments SCALE INVERTED;RA-2306 (RUSSIAN)
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H13F3S
InChI InChI=1S/C10H13F3S/c1-4-14-9(10(11,12)13)7-5-6-8(2)3/h7-8H,4H2,1-3H3/b9-7-
InChIKey LIGOYHHCLUMLMX-CLFYSBASSA-N
Instrument Name SEE COMMENT
Literature Reference E.S. TURBANOVA, N.A.ORLOVA, A.A.PETROV (1978) Zhurn.Org.Khim.(Russ. Lang.):v.14, N6, 1170-1177.
NMR Standard -CF3COOH external
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported