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1-Adamantyl-2-(4-fluorophenyl)-2-phenylethane

View entire compound with spectra: 1 NMR, and 1 FTIR

1-Adamantyl-2-(4-fluorophenyl)-2-phenylethane
SpectraBase Compound ID Gkoc5g1u9qg
InChI InChI=1S/C24H27F/c25-22-8-6-21(7-9-22)23(20-4-2-1-3-5-20)16-24-13-17-10-18(14-24)12-19(11-17)15-24/h1-9,17-19,23H,10-16H2
InChIKey APSLUXYPSBURPU-UHFFFAOYSA-N
Mol Weight 334.48 g/mol
Molecular Formula C24H27F
Exact Mass 334.209679 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3BS69rpABln
Name 1-Adamantyl-2-(4-fluorophenyl)-2-phenylethane
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 334.209679032 u
Formula C24H27F
InChI InChI=1S/C24H27F/c25-22-8-6-21(7-9-22)23(20-4-2-1-3-5-20)16-24-13-17-10-18(14-24)12-19(11-17)15-24/h1-9,17-19,23H,10-16H2
InChIKey APSLUXYPSBURPU-UHFFFAOYSA-N
Molecular Weight 334.478 g/mol
SMILES C1=C(C=CC(=C1)F)C(C1=CC=CC=C1)CC12CC3CC(CC(C3)C1)C2
Spectrum/Structure Validation Score (Vapor Phase IR) 0.926037