| 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 |