| SpectraBase Compound ID | 7HzFcfRejZe |
|---|---|
| InChI | InChI=1S/C13H16/c1-2-4-11-10(3-1)12-8-5-6-9(7-8)13(11)12/h1-2,8-9,12-13H,3-7H2/t8-,9+,12+,13- |
| InChIKey | HBRXUODSNNWGKD-JDNZLRHBSA-N |
| Mol Weight | 172.27 g/mol |
| Molecular Formula | C13H16 |
| Exact Mass | 172.125201 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 6f1aBEAQFk4 |
|---|---|
| Name | 1,4-Methanobiphenylene, 1,2,3,4,4a,5,8,8b-octahydro-, (1.alpha.,4.alpha.,4a.alpha.,8b.alpha.)- |
| Alternate Name(s) | 1,4-Methanobiphenylene, 1,2,3,4,4a,5,8,8b-octahydro-, (1.alpha.,4.alpha.,4a.beta.,8b.beta.)- (1R,2R,9S,10S)-tetracyclo[8.2.1.0(2,9).0(3,8)]trideca-3(8),5-diene endo-1,2,3,4,4a,5,8,8b-octahydro-1,4-methanobiphenylene exo-1,2,3,4,4a,5,8,8b-Octahydro-1,4-methanobiphenylene |
| CAS Registry Number | 60247-69-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H16 |
| InChI | InChI=1S/C13H16/c1-2-4-11-10(3-1)12-8-5-6-9(7-8)13(11)12/h1-2,8-9,12-13H,3-7H2/t8-,9+,12+,13- |
| InChIKey | HBRXUODSNNWGKD-JDNZLRHBSA-N |
| Molecular Weight | 172.271 g/mol |
| SMILES | C12=C(CC=CC2)[C@@]2([C@]1([C@]1(C[C@]2([H])CC1)[H])[H])[H] |
| SPLASH | splash10-003r-3900000000-a5f73d95be39a2921201 |
| Source of Spectrum | C-102-668-0 |
| Wiley ID | 1169503 |