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

*Links on SpectraBase are not permalinks.

1-(4-Fluorophenyl)-4-(4-hexyloxyphenyl)buta-1,3-diene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-(4-Fluorophenyl)-4-(4-hexyloxyphenyl)buta-1,3-diene
SpectraBase Compound ID K9Lio3T0eyy
InChI InChI=1S/C22H25FO/c1-2-3-4-7-18-24-22-16-12-20(13-17-22)9-6-5-8-19-10-14-21(23)15-11-19/h5-6,8-17H,2-4,7,18H2,1H3/b8-5+,9-6+
InChIKey UPOJPVOYIVEBHU-XVYDYJIPSA-N
Mol Weight 324.44 g/mol
Molecular Formula C22H25FO
Exact Mass 324.188944 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 DUDmN4wGhl8
Name 1-(4-Fluorophenyl)-4-(4-hexyloxyphenyl)buta-1,3-diene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 324.188943587 u
Formula C22H25FO
InChI InChI=1S/C22H25FO/c1-2-3-4-7-18-24-22-16-12-20(13-17-22)9-6-5-8-19-10-14-21(23)15-11-19/h5-6,8-17H,2-4,7,18H2,1H3/b8-5+,9-6+
InChIKey UPOJPVOYIVEBHU-XVYDYJIPSA-N
Molecular Weight 324.439 g/mol
SMILES C=1(\C=C\C=C\C=2C=CC(=CC2)F)C=CC(=CC1)OCCCCCC