For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3,4'-Dimethoxy-2'-hydroxychalcone, pentafluoropropionate
SpectraBase Compound ID OgcIkpaBRs
InChI InChI=1S/C20H15F5O5/c1-28-13-5-3-4-12(10-13)6-9-16(26)15-8-7-14(29-2)11-17(15)30-18(27)19(21,22)20(23,24)25/h3-11H,1-2H3/b9-6+
InChIKey IZGCMPIERCCOJL-RMKNXTFCSA-N
Mol Weight 430.33 g/mol
Molecular Formula C20H15F5O5
Exact Mass 430.083964 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 3tpnTgzUM9r
Name 3,4'-Dimethoxy-2'-hydroxychalcone, pentafluoropropionate
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 430.083964393 u
Formula C20H15F5O5
InChI InChI=1S/C20H15F5O5/c1-28-13-5-3-4-12(10-13)6-9-16(26)15-8-7-14(29-2)11-17(15)30-18(27)19(21,22)20(23,24)25/h3-11H,1-2H3/b9-6+
InChIKey IZGCMPIERCCOJL-RMKNXTFCSA-N
Molecular Weight 430.327 g/mol
SMILES C1(=CC=C(C=C1OC(C(C(F)(F)F)(F)F)=O)OC)C(\C=C\C1=CC(=CC=C1)OC)=O