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[(E)/(Z)]-2-(3,3,3-Trifluoroprop-1-en-1-yl)-naphthalene

View entire compound with spectra: 3 NMR, 1 FTIR, and 2 MS (GC)

[(E)/(Z)]-2-(3,3,3-Trifluoroprop-1-en-1-yl)-naphthalene
SpectraBase Compound ID ISLqmtA3O6d
InChI InChI=1S/C13H9F3/c14-13(15,16)8-7-10-5-6-11-3-1-2-4-12(11)9-10/h1-9H/b8-7+
InChIKey LUDPTKMULHKDEW-BQYQJAHWSA-N
Mol Weight 222.21 g/mol
Molecular Formula C13H9F3
Exact Mass 222.065635 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID DhEbHkBH6g9
Name [(E)/(Z)]-2-(3,3,3-Trifluoroprop-1-en-1-yl)-naphthalene
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 222.065634779 u
Formula C13H9F3
InChI InChI=1S/C13H9F3/c14-13(15,16)8-7-10-5-6-11-3-1-2-4-12(11)9-10/h1-9H/b8-7+
InChIKey LUDPTKMULHKDEW-BQYQJAHWSA-N
Molecular Weight 222.210 g/mol
SMILES C(F)(\C=C\C1=CC2=C(C=C1)C=CC=C2)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.831565