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4-Chloranyl-2-(2-phenylethynyl)phenol

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

4-Chloranyl-2-(2-phenylethynyl)phenol
SpectraBase Compound ID Cn1JrWpG1zm
InChI InChI=1S/C14H9ClO/c15-13-8-9-14(16)12(10-13)7-6-11-4-2-1-3-5-11/h1-5,8-10,16H
InChIKey YYBUGZZRLWJMLF-UHFFFAOYSA-N
Mol Weight 228.68 g/mol
Molecular Formula C14H9ClO
Exact Mass 228.034193 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 3GK8BkUE4Lv
Name 4-Chloranyl-2-(2-phenylethynyl)phenol
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 228.034192609 u
Formula C14H9ClO
InChI InChI=1S/C14H9ClO/c15-13-8-9-14(16)12(10-13)7-6-11-4-2-1-3-5-11/h1-5,8-10,16H
InChIKey YYBUGZZRLWJMLF-UHFFFAOYSA-N
Molecular Weight 228.678 g/mol
SMILES C(#CC1=CC=CC=C1)C=1C(=CC=C(C1)Cl)O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.959419