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Oroxylin A, bis(pentafluoropropionate)

View entire compound with spectra: 1 NMR

Oroxylin A, bis(pentafluoropropionate)
SpectraBase Compound ID LDNZwsefkxf
InChI InChI=1S/C22H10F10O7/c1-36-15-13(38-17(34)19(23,24)21(27,28)29)8-12-14(16(15)39-18(35)20(25,26)22(30,31)32)10(33)7-11(37-12)9-5-3-2-4-6-9/h2-8H,1H3
InChIKey XAZNVYZSNFYTOA-UHFFFAOYSA-N
Mol Weight 576.3 g/mol
Molecular Formula C22H10F10O7
Exact Mass 576.026684 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 9e4rBohPBG1
Name Oroxylin A, bis(pentafluoropropionate)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 576.026684285 u
Formula C22H10F10O7
InChI InChI=1S/C22H10F10O7/c1-36-15-13(38-17(34)19(23,24)21(27,28)29)8-12-14(16(15)39-18(35)20(25,26)22(30,31)32)10(33)7-11(37-12)9-5-3-2-4-6-9/h2-8H,1H3
InChIKey XAZNVYZSNFYTOA-UHFFFAOYSA-N
Molecular Weight 576.299 g/mol
SMILES C1(OC(C(C(F)(F)F)(F)F)=O)=C2C(OC(=CC2=O)C2=CC=CC=C2)=CC(=C1OC)OC(C(C(F)(F)F)(F)F)=O