![14-Methyl-10,12-bisdehydro-4,9-methano-1H-[19]annulen-1-one](/api/spectrum/Az3Km6exAwF/structure.png?h=300&w=458 "14-Methyl-10,12-bisdehydro-4,9-methano-1H-[19]annulen-1-one")
| SpectraBase Compound ID | IefAc5fAZQR |
|---|---|
| InChI | InChI=1S/C21H16O/c1-18-9-3-2-4-14-21(22)16-15-20-13-8-7-12-19(17-20)11-6-5-10-18/h2-4,7-9,12-16H,17H2,1H3/b3-2+,14-4-,16-15+,18-9- |
| InChIKey | DMAIWIDKYOJOMW-PNANKLKYSA-N |
| Mol Weight | 284.36 g/mol |
| Molecular Formula | C21H16O |
| Exact Mass | 284.120115 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | Az3Km6exAwF |
|---|---|
| Name | 14-Methyl-10,12-bisdehydro-4,9-methano-1H-[19]annulen-1-one |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C21H16O |
| InChI | InChI=1S/C21H16O/c1-18-9-3-2-4-14-21(22)16-15-20-13-8-7-12-19(17-20)11-6-5-10-18/h2-4,7-9,12-16H,17H2,1H3/b3-2+,14-4-,16-15+,18-9- |
| InChIKey | DMAIWIDKYOJOMW-PNANKLKYSA-N |
| Molecular Weight | 284.358 g/mol |
| SMILES | C#1C#C\C(=C/C=C/C=C\C(\C=C\C=2CC(C1)=CC=CC2)=O)C |
| SPLASH | splash10-000i-0090000000-40bfd47178274f4e5bb0 |
| Source of Spectrum | AJ-68-3536-18 |
| Synonyms | 10-methylbicyclo[13.4.1]icosa-1(19),2,5,7,9,15,17-heptaene-11,13-diyn-4-one (2E,5Z,7E,9Z)-10-methyl-4-bicyclo[13.4.1]eicosa-1(19),2,5,7,9,15,17-heptaen-11,13-diynone (2E,5Z,7E,9Z)-10-methylbicyclo[13.4.1]icosa-1(19),2,5,7,9,15,17-heptaen-11,13-diyn-4-one |
| Wiley ID | 773481 |