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2-(3,3-Diphenylcycloprop-1-en-1-yl)-3,3-bis(4-fluorophenyl)-1-(naphthalen-1-yl)prop-2-en-1-ol

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2-(3,3-Diphenylcycloprop-1-en-1-yl)-3,3-bis(4-fluorophenyl)-1-(naphthalen-1-yl)prop-2-en-1-ol
SpectraBase Compound ID C9VzMC1NrWt
InChI InChI=1S/C40H28F2O/c41-32-22-18-28(19-23-32)37(29-20-24-33(42)25-21-29)38(39(43)35-17-9-11-27-10-7-8-16-34(27)35)36-26-40(36,30-12-3-1-4-13-30)31-14-5-2-6-15-31/h1-26,39,43H
InChIKey QDTMDYDXWULHJK-UHFFFAOYSA-N
Mol Weight 562.7 g/mol
Molecular Formula C40H28F2O
Exact Mass 562.210822 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Hjc6aQy0u5S
Name 2-(3,3-Diphenylcycloprop-1-en-1-yl)-3,3-bis(4-fluorophenyl)-1-(naphthalen-1-yl)prop-2-en-1-ol
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 562.210821847 u
Formula C40H28F2O
InChI InChI=1S/C40H28F2O/c41-32-22-18-28(19-23-32)37(29-20-24-33(42)25-21-29)38(39(43)35-17-9-11-27-10-7-8-16-34(27)35)36-26-40(36,30-12-3-1-4-13-30)31-14-5-2-6-15-31/h1-26,39,43H
InChIKey QDTMDYDXWULHJK-UHFFFAOYSA-N
Molecular Weight 562.660 g/mol
SMILES C=1(C=CC=CC1)C1(C=C1C(C(O)C1=CC=CC=2C1=CC=CC2)=C(C1=CC=C(C=C1)F)C=1C=CC(=CC1)F)C1=CC=CC=C1