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(.+/-.)-naringenin, o,o',o''-tri(heptafluorobutyryl)-

View entire compound with spectra: 1 NMR

(.+/-.)-naringenin, o,o',o''-tri(heptafluorobutyryl)-
SpectraBase Compound ID IebodNWlqck
InChI InChI=1S/C27H9F21O8/c28-19(29,22(34,35)25(40,41)42)16(50)53-9-3-1-8(2-4-9)12-7-11(49)15-13(55-12)5-10(54-17(51)20(30,31)23(36,37)26(43,44)45)6-14(15)56-18(52)21(32,33)24(38,39)27(46,47)48/h1-6,12H,7H2
InChIKey LYRBAENCAKZYNA-UHFFFAOYSA-N
Mol Weight 860.33 g/mol
Molecular Formula C27H9F21O8
Exact Mass 859.996209 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1O3GGOExGhj
Name (.+/-.)-naringenin, o,o',o''-tri(heptafluorobutyryl)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 859.996208665 u
Formula C27H9F21O8
InChI InChI=1S/C27H9F21O8/c28-19(29,22(34,35)25(40,41)42)16(50)53-9-3-1-8(2-4-9)12-7-11(49)15-13(55-12)5-10(54-17(51)20(30,31)23(36,37)26(43,44)45)6-14(15)56-18(52)21(32,33)24(38,39)27(46,47)48/h1-6,12H,7H2
InChIKey LYRBAENCAKZYNA-UHFFFAOYSA-N
Molecular Weight 860.327 g/mol
SMILES C12=CC(OC(=O)C(C(C(F)(F)F)(F)F)(F)F)=CC(=C2C(CC(O1)C1=CC=C(C=C1)OC(=O)C(C(C(F)(F)F)(F)F)(F)F)=O)OC(=O)C(C(C(F)(F)F)(F)F)(F)F