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(.+/-.)-naringenin, o,o'-bis(heptafluorobutyryl)-
SpectraBase Compound ID 6CwLD1g9LRF
InChI InChI=1S/C23H10F14O7/c24-18(25,20(28,29)22(32,33)34)16(40)42-9-3-1-8(2-4-9)13-7-12(39)15-11(38)5-10(6-14(15)44-13)43-17(41)19(26,27)21(30,31)23(35,36)37/h1-6,13,38H,7H2
InChIKey YPKYMBZEVUBIDE-UHFFFAOYSA-N
Mol Weight 664.3 g/mol
Molecular Formula C23H10F14O7
Exact Mass 664.020297 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BWKggRVIT8O
Name (.+/-.)-naringenin, o,o'-bis(heptafluorobutyryl)-
Comments Computed using HOSE algorithm
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Exact Mass 664.020296937 u
Formula C23H10F14O7
InChI InChI=1S/C23H10F14O7/c24-18(25,20(28,29)22(32,33)34)16(40)42-9-3-1-8(2-4-9)13-7-12(39)15-11(38)5-10(6-14(15)44-13)43-17(41)19(26,27)21(30,31)23(35,36)37/h1-6,13,38H,7H2
InChIKey YPKYMBZEVUBIDE-UHFFFAOYSA-N
Molecular Weight 664.304 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)O