| SpectraBase Spectrum ID |
DWhy67eI3mc |
| Name |
1,4-bis((4-Methoxyphenyl)ethynyl)benzene |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
338.130679818 u |
| Formula |
C24H18O2 |
| InChI |
InChI=1S/C24H18O2/c1-25-23-15-11-21(12-16-23)9-7-19-3-5-20(6-4-19)8-10-22-13-17-24(26-2)18-14-22/h3-6,11-18H,1-2H3 |
| InChIKey |
XTOTWCSWPHHCBG-UHFFFAOYSA-N |
| Molecular Weight |
338.406 g/mol |
| SMILES |
C=1(C=CC(=CC1)C#CC=1C=CC(=CC1)OC)C#CC=1C=CC(=CC1)OC |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.897803 |
