| SpectraBase Spectrum ID |
4o2h2TtFWqD |
| Name |
1-(6-Acetylcyclohepta-1,3,5-trieny)-7-methylnona-1,4,6-trien-8-yn-3-one |
| Alternate Name(s) |
(1E,4E,6E)-1-(6-acetyl-1,3,5-cycloheptatrien-1-yl)-7-methyl-1,4,6-nonatrien-8-yn-3-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H18O2 |
| InChI |
InChI=1S/C19H18O2/c1-4-15(2)8-7-11-19(21)13-12-17-9-5-6-10-18(14-17)16(3)20/h1,5-13H,14H2,2-3H3/b11-7+,13-12+,15-8+ |
| InChIKey |
FQULLMAXLUREME-LVIMKYHXSA-N |
| Molecular Weight |
278.351 g/mol |
| SMILES |
C=1(C(=O)C)CC(\C=C\C(\C=C\C=C\(C#C)C)=O)=CC=CC1 |
| SPLASH |
splash10-016r-0950000000-0ff011989ce5704c4c72 |
| Source of Spectrum |
KC-0-1585-27 |
| Wiley ID |
781251 |
