| SpectraBase Compound ID | HeNOfnqqAj3 |
|---|---|
| InChI | InChI=1S/C20H20O/c21-17-9-3-7-15-14-6-1-4-12-10-11-13-5-2-8-16(20(15)17)19(13)18(12)14/h10-11H,1-9H2 |
| InChIKey | UIJOUFUKJPLQEK-UHFFFAOYSA-N |
| Mol Weight | 276.38 g/mol |
| Molecular Formula | C20H20O |
| Exact Mass | 276.151415 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BehRPXkwUMU |
|---|---|
| Name | 1,3,6,7,8,10,11,12-Octahydrobenzo[e]pyren-9(2H)-one |
| CAS Registry Number | 68151-08-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C20H20O |
| InChI | InChI=1S/C20H20O/c21-17-9-3-7-15-14-6-1-4-12-10-11-13-5-2-8-16(20(15)17)19(13)18(12)14/h10-11H,1-9H2 |
| InChIKey | UIJOUFUKJPLQEK-UHFFFAOYSA-N |
| Molecular Weight | 276.379 g/mol |
| SMILES | c1cc2CCCc3c2c2c1CCCc2c1CCCC(c31)=O |
| SPLASH | splash10-004i-0390000000-7926fcb446e36e2a1a7a |
| Source of Spectrum | W5-1989-25656-1 |
| Synonyms | 1,2,3,6,7,8,11,12-Octahydrobenzo(E)pyren-9(10H)-one 2,3,6,7,8,10,11,12-octahydro-1H-benzo[e]pyren-9-one Benzo[e]pyren-9(2H)-one, 1,3,6,7,8,10,11,12-octahydro- EINECS 268-853-3 |
| Wiley ID | 1280677 |