| SpectraBase Spectrum ID |
IS5pE53eNh5 |
| Name |
1,6-Heptadien-4-yn-3-one |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C7H6O |
| InChI |
InChI=1S/C7H6O/c1-3-5-6-7(8)4-2/h3-4H,1-2H2 |
| InChIKey |
RQGHVHWCRMLOJO-UHFFFAOYSA-N |
| Instrument Name |
Agilent HP 6890 or Waters Autospec Premier sprctrometer magnetic sector |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201908496 |
| Molecular Weight |
106.124 g/mol |
| Reported Formula |
C7H6O |
| SMILES |
C=CC(C#CC=C)=O |
| SPLASH |
splash10-004i-9200000000-499a3331213fb35477bc |
| Source of Spectrum |
ACI-58-SM17-7 |
| Thin-Layer Chromatography |
Rf = 0.26 (petroleum ether/Et2O, 90:10) |
| Wiley ID |
1875566 |
