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1,3-Dimethyl-2-(4-fluorophenyl)-7-fluoronaphthalene
SpectraBase Compound ID 3c0vhwoX5hM
InChI InChI=1S/C18H14F2/c1-11-9-14-5-8-16(20)10-17(14)12(2)18(11)13-3-6-15(19)7-4-13/h3-10H,1-2H3
InChIKey PYEPRYXNFMWPPX-UHFFFAOYSA-N
Mol Weight 268.31 g/mol
Molecular Formula C18H14F2
Exact Mass 268.106357 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GPn7xaMTa6p
Name 1,3-Dimethyl-2-(4-fluorophenyl)-7-fluoronaphthalene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 268.106356777 u
Formula C18H14F2
InChI InChI=1S/C18H14F2/c1-11-9-14-5-8-16(20)10-17(14)12(2)18(11)13-3-6-15(19)7-4-13/h3-10H,1-2H3
InChIKey PYEPRYXNFMWPPX-UHFFFAOYSA-N
Molecular Weight 268.307 g/mol
SMILES C=1(C(=C(C)C=C2C1C=C(C=C2)F)C=1C=CC(=CC1)F)C
Spectrum/Structure Validation Score (Vapor Phase IR) 0.892581