| SpectraBase Compound ID | BTanMpxb9Zv |
|---|---|
| InChI | InChI=1S/C16H14O2/c1-16(2,3)12-11-15(18)14(17)10-9-13-7-5-4-6-8-13/h4-8H,1-3H3 |
| InChIKey | QXIUHZUORYYXFE-UHFFFAOYSA-N |
| Mol Weight | 238.29 g/mol |
| Molecular Formula | C16H14O2 |
| Exact Mass | 238.09938 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JaNj5GS0OTG |
|---|---|
| Name | 7,7-Dimethyl-1-phenyl-octa-1,5-diyne-3,4-dione |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C16H14O2 |
| InChI | InChI=1S/C16H14O2/c1-16(2,3)12-11-15(18)14(17)10-9-13-7-5-4-6-8-13/h4-8H,1-3H3 |
| InChIKey | QXIUHZUORYYXFE-UHFFFAOYSA-N |
| Molecular Weight | 238.286 g/mol |
| SMILES | CC(C#CC(C(C#Cc1ccccc1)=O)=O)(C)C |
| SPLASH | splash10-004i-0900000000-cdf472b3c69ba216de90 |
| Source of Spectrum | U-1996-1238-7 |
| Wiley ID | 768666 |