| SpectraBase Spectrum ID |
4XqtCYI0h1n |
| Name |
(2E,5E,7Z)-5,8-dimethyl-4-bicyclo[11.4.1]octadeca-1(17),2,5,7,13,15-hexaen-9,11-diynone |
| Alternate Name(s) |
(2E,5E,7Z)-5,8-dimethylbicyclo[11.4.1]octadeca-1(17),2,5,7,13,15-hexaen-9,11-diyn-4-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H16O |
| InChI |
InChI=1S/C20H16O/c1-16-7-3-4-8-18-9-5-6-10-19(15-18)13-14-20(21)17(2)12-11-16/h5-6,9-14H,15H2,1-2H3/b14-13+,16-11-,17-12+ |
| InChIKey |
NXENSKXSFIDBTC-VXPPCNNVSA-N |
| Molecular Weight |
272.347 g/mol |
| SMILES |
C#1C#C\C(=C/C=C\(C)C(\C=C\C=2CC(C1)=CC=CC2)=O)C |
| SPLASH |
splash10-00b9-0090000000-b2d9f4be5475fce25225 |
| Source of Spectrum |
AJ-68-3535-14 |
| Wiley ID |
773484 |
![(2E,5E,7Z)-5,8-dimethyl-4-bicyclo[11.4.1]octadeca-1(17),2,5,7,13,15-hexaen-9,11-diynone](/api/spectrum/4XqtCYI0h1n/structure.png?h=300&w=458 "(2E,5E,7Z)-5,8-dimethyl-4-bicyclo[11.4.1]octadeca-1(17),2,5,7,13,15-hexaen-9,11-diynone")
