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Ethanone, 2,2'-[2,4-hexadiyne-1,6-diylbis(oxy)]bis[1,2-diphenyl-
SpectraBase Compound ID 31cHJHa57Oh
InChI InChI=1S/C34H26O4/c35-31(27-17-7-3-8-18-27)33(29-21-11-5-12-22-29)37-25-15-1-2-16-26-38-34(30-23-13-6-14-24-30)32(36)28-19-9-4-10-20-28/h3-14,17-24,33-34H,25-26H2
InChIKey FNHWZFNVEARSEE-UHFFFAOYSA-N
Mol Weight 498.6 g/mol
Molecular Formula C34H26O4
Exact Mass 498.183109 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 65LMVnn5dty
Name Ethanone, 2,2'-[2,4-hexadiyne-1,6-diylbis(oxy)]bis[1,2-diphenyl-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 498.183109313 u
Formula C34H26O4
InChI InChI=1S/C34H26O4/c35-31(27-17-7-3-8-18-27)33(29-21-11-5-12-22-29)37-25-15-1-2-16-26-38-34(30-23-13-6-14-24-30)32(36)28-19-9-4-10-20-28/h3-14,17-24,33-34H,25-26H2
InChIKey FNHWZFNVEARSEE-UHFFFAOYSA-N
Molecular Weight 498.578 g/mol
SMILES C(=O)(C(OCC#CC#CCOC(C(=O)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1)C1=CC=CC=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.94567