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1,4-Pentadien-3-one, 1,5-bis[4-(trifluoromethyl)phenyl]-
SpectraBase Compound ID 2iZGoX0uoGf
InChI InChI=1S/C19H12F6O/c20-18(21,22)15-7-1-13(2-8-15)5-11-17(26)12-6-14-3-9-16(10-4-14)19(23,24)25/h1-12H/b11-5+,12-6+
InChIKey OIUBVYQZMUKRRF-YDWXAUTNSA-N
Mol Weight 370.29 g/mol
Molecular Formula C19H12F6O
Exact Mass 370.079234 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID ECLl7AM9U18
Name 1,4-Pentadien-3-one, 1,5-bis[4-(trifluoromethyl)phenyl]-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 370.079233983 u
Formula C19H12F6O
InChI InChI=1S/C19H12F6O/c20-18(21,22)15-7-1-13(2-8-15)5-11-17(26)12-6-14-3-9-16(10-4-14)19(23,24)25/h1-12H/b11-5+,12-6+
InChIKey OIUBVYQZMUKRRF-YDWXAUTNSA-N
Molecular Weight 370.294 g/mol
SMILES C=1(\C=C\C(\C=C\C=2C=CC(=CC2)C(F)(F)F)=O)C=CC(=CC1)C(F)(F)F