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3-(4-Fluorobenzyl)-5-(4-fluorophenyl)-2-phenylthiophene

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

3-(4-Fluorobenzyl)-5-(4-fluorophenyl)-2-phenylthiophene
SpectraBase Compound ID 7tV96e0tCDC
InChI InChI=1S/C23H16F2S/c24-20-10-6-16(7-11-20)14-19-15-22(17-8-12-21(25)13-9-17)26-23(19)18-4-2-1-3-5-18/h1-13,15H,14H2
InChIKey QREZDBZBBUYYRL-UHFFFAOYSA-N
Mol Weight 362.44 g/mol
Molecular Formula C23H16F2S
Exact Mass 362.094078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6CHbXlDVIJ9
Name 3-(4-Fluorobenzyl)-5-(4-fluorophenyl)-2-phenylthiophene
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 362.094078015 u
Formula C23H16F2S
InChI InChI=1S/C23H16F2S/c24-20-10-6-16(7-11-20)14-19-15-22(17-8-12-21(25)13-9-17)26-23(19)18-4-2-1-3-5-18/h1-13,15H,14H2
InChIKey QREZDBZBBUYYRL-UHFFFAOYSA-N
Molecular Weight 362.438 g/mol
SMILES C=1(SC(=CC1CC1=CC=C(C=C1)F)C=1C=CC(=CC1)F)C1=CC=CC=C1