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6-FLUORO-D-BIOTIN METHYL ESTER (ISOMER 1)
SpectraBase Compound ID CpHmotShRzA
InChI InChI=1S/C11H17FN2O3S/c1-17-7(15)5-3-2-4-6-8-9(10(12)18-6)14-11(16)13-8/h6,8-10H,2-5H2,1H3,(H2,13,14,16)/t6-,8+,9+,10+/m1/s1
InChIKey IUDUASKOEYIUGE-CUJWVEQBSA-N
Mol Weight 276.33 g/mol
Molecular Formula C11H17FN2O3S
Exact Mass 276.094392 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8QRqO8V70uv
Name 6-FLUORO-D-BIOTIN METHYL ESTER (ISOMER 1)
Comments INTERNAL STANDARD-C6F6 (-162.9 FROM CFCL3)
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Formula C11H17FN2O3S
InChI InChI=1S/C11H17FN2O3S/c1-17-7(15)5-3-2-4-6-8-9(10(12)18-6)14-11(16)13-8/h6,8-10H,2-5H2,1H3,(H2,13,14,16)/t6-,8+,9+,10+/m1/s1
InChIKey IUDUASKOEYIUGE-CUJWVEQBSA-N
Instrument Name Bruker WH-90
Literature Reference XIAOLING HUANG, BARRY J. BLACKBURN, ALEXANDER F. JANZEN (1990) J.Fluor.Chem.:v.47, N1, 145-150.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent C2D3N acetonitrile-d