![5,10:6,9-Dimethanobenzo[b]biphenylene, 4b,5,5a,6,7,8,9,9a,10,10a-decahydro-, (4a.alpha.,5.alpha.,5a.beta.,6.beta.,9.beta.,9a.beta.,10.alpha.,10a.alpha.)-](/api/spectrum/GQsRV41aixz/structure.png?h=300&w=458 "5,10:6,9-Dimethanobenzo[b]biphenylene, 4b,5,5a,6,7,8,9,9a,10,10a-decahydro-, (4a.alpha.,5.alpha.,5a.beta.,6.beta.,9.beta.,9a.beta.,10.alpha.,10a.alpha.)-")
| SpectraBase Compound ID | CLCTK0LH9e0 |
|---|---|
| InChI | InChI=1S/C18H20/c1-2-4-12-11(3-1)17-13-8-14(18(12)17)16-10-6-5-9(7-10)15(13)16/h1-4,9-10,13-18H,5-8H2/t9-,10-,13-,14-,15-,16+,17?,18+/m0/s1 |
| InChIKey | PJXRWKGGTQJOIQ-AXFZUHQCSA-N |
| Mol Weight | 236.36 g/mol |
| Molecular Formula | C18H20 |
| Exact Mass | 236.156501 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | GQsRV41aixz |
|---|---|
| Name | 5,10:6,9-Dimethanobenzo[b]biphenylene, 4b,5,5a,6,7,8,9,9a,10,10a-decahydro-, (4a.alpha.,5.alpha.,5a.beta.,6.beta.,9.beta.,9a.beta.,10.alpha.,10a.alpha.)- |
| CAS Registry Number | 72243-84-6 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C18H20 |
| InChI | InChI=1S/C18H20/c1-2-4-12-11(3-1)17-13-8-14(18(12)17)16-10-6-5-9(7-10)15(13)16/h1-4,9-10,13-18H,5-8H2/t9-,10-,13-,14-,15-,16+,17?,18+/m0/s1 |
| InChIKey | PJXRWKGGTQJOIQ-AXFZUHQCSA-N |
| Molecular Weight | 236.358 g/mol |
| SMILES | [C@]12(C([C@@]3([H])C[C@]2([C@@]2([C@]3([C@]3([H])C[C@@]2(CC3)[H])[H])[H])[H])c2c1cccc2)[H] |
| SPLASH | splash10-00kf-4900000000-0f8a3a1f89fc881fd4c2 |
| Source of Spectrum | C-102-676-0 |
| Synonyms | (1S,2R,10S,11S,12S,15S,16R)-hexacyclo[8.6.1.1(12,15).0(2,9).0(3,8).0(11,16)]octadeca-3,5,7-triene endo,exo,endo-1,4,4a,5,5a,6,9,9b,10,10a-decahydro-1,4:5,10-dimethanobenzobiphenylene endo,exo,exo-1,2,3,4,4a,5,5a,9b,10,10a-decahydro-1,4:5,10-dimethanobenzobiphenylene endo,exo,exo-1,4,4a,5,5a,6,9,9b,10,10a-decahydro-1,4:5,10-dimethaobenzobiphenylene |
| Wiley ID | 1239189 |