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

*Links on SpectraBase are not permalinks.

5'-Fluoro-2'-(trifluoroacetyl)oxy-4-methoxychalcone (isomer 2)

View entire compound with spectra: 1 NMR

5'-Fluoro-2'-(trifluoroacetyl)oxy-4-methoxychalcone (isomer 2)
SpectraBase Compound ID 3alDJL8gUa5
InChI InChI=1S/C18H12F4O4/c1-25-13-6-2-11(3-7-13)4-8-15(23)14-10-12(19)5-9-16(14)26-17(24)18(20,21)22/h2-10H,1H3/b8-4+
InChIKey XHSGBXPMXNRUKC-XBXARRHUSA-N
Mol Weight 368.28 g/mol
Molecular Formula C18H12F4O4
Exact Mass 368.067172 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 CpbKsHgQcJO
Name 5'-Fluoro-2'-(trifluoroacetyl)oxy-4-methoxychalcone (isomer 2)
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 368.067171514 u
Formula C18H12F4O4
InChI InChI=1S/C18H12F4O4/c1-25-13-6-2-11(3-7-13)4-8-15(23)14-10-12(19)5-9-16(14)26-17(24)18(20,21)22/h2-10H,1H3/b8-4+
InChIKey XHSGBXPMXNRUKC-XBXARRHUSA-N
Molecular Weight 368.284 g/mol
SMILES C1(=C(C=CC(=C1)F)OC(C(F)(F)F)=O)C(\C=C\C=1C=CC(=CC1)OC)=O