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3,5,6,7,8-PENTAFLUORO-1,3,4-TRIOXO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE
SpectraBase Compound ID 2ht2rmBwUIL
InChI InChI=1S/C9HF4NO3/c10-3-1-2(4(11)6(13)5(3)12)8(16)14-9(17)7(1)15/h(H,14,16,17)
InChIKey PSJBDRADCWCNDH-UHFFFAOYSA-N
Mol Weight 247.1 g/mol
Molecular Formula C9HF4NO3
Exact Mass 246.989256 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9JUnsYemaRD
Name 3,5,6,7,8-PENTAFLUORO-1,3,4-TRIOXO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE
Comments SCALE INVERTED
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C9HF4NO3
InChI InChI=1S/C9HF4NO3/c10-3-1-2(4(11)6(13)5(3)12)8(16)14-9(17)7(1)15/h(H,14,16,17)
InChIKey PSJBDRADCWCNDH-UHFFFAOYSA-N
Instrument Name Jeol C-60 HL
Literature Reference P.SARTORI, K.AHLERS, H.-J.FROHN (1976) J.Fluor.Chem.: v.8, N5, 457-460.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported