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3ALPHA,6ALPHA-DIHYDROXY-24,24,25,26,26,26,27,27,27-NONAFLUORO-5BETA-CHOLESTANE
SpectraBase Compound ID AwvsrvaL4Gh
InChI InChI=1S/C27H39F9O2/c1-14(6-11-24(28,29)25(30,26(31,32)33)27(34,35)36)17-4-5-18-16-13-21(38)20-12-15(37)7-9-23(20,3)19(16)8-10-22(17,18)2/h14-21,37-38H,4-13H2,1-3H3/t14-,15-,16?,17-,18?,19?,20+,21+,22-,23-/m0/s1
InChIKey MLWORKYYRNEAFP-WJKSLPDISA-N
Mol Weight 566.6 g/mol
Molecular Formula C27H39F9O2
Exact Mass 566.280634 g/mol

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

19F Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1VF4D8Ca5AX
Name 3ALPHA,6ALPHA-DIHYDROXY-24,24,25,26,26,26,27,27,27-NONAFLUORO-5BETA-CHOLESTANE
Comments EXTERNAL STANDARD - CF3COOH (76.8 FROM CFCL3). SCALE INVERTED. NAME
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H39F9O2
InChI InChI=1S/C27H39F9O2/c1-14(6-11-24(28,29)25(30,26(31,32)33)27(34,35)36)17-4-5-18-16-13-21(38)20-12-15(37)7-9-23(20,3)19(16)8-10-22(17,18)2/h14-21,37-38H,4-13H2,1-3H3/t14-,15-,16?,17-,18?,19?,20+,21+,22-,23-/m0/s1
InChIKey MLWORKYYRNEAFP-WJKSLPDISA-N
Instrument Name Varian EM-360
Literature Reference WEI-YUAN HUANG, LI-QING HU, WEN-ZHE GE (1989) J.Fluor.Chem.: v.43, N3, 305-318.
NMR Standard CCl3F
Observed nucleus 19F
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported