| SpectraBase Compound ID | LahFWlFqIue |
|---|---|
| InChI | InChI=1S/C12H8Cl6/c13-8-9(14)11(16)7-5-2-1-4(3-5)6(7)10(8,15)12(11,17)18/h1-2,4-7H,3H2/t4?,5?,6?,7?,10-,11+ |
| InChIKey | QBYJBZPUGVGKQQ-LYSYVJQESA-N |
| Mol Weight | 364.9 g/mol |
| Molecular Formula | C12H8Cl6 |
| Exact Mass | 361.875716 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AvLEB2q3lya |
|---|---|
| Name | ALDRINE 2 |
| CAS Registry Number | 309-00-2 |
| Copyright | Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass | 361.875716458 u |
| Formula | C12H8Cl6 |
| InChI | InChI=1S/C12H8Cl6/c13-8-9(14)11(16)7-5-2-1-4(3-5)6(7)10(8,15)12(11,17)18/h1-2,4-7H,3H2/t4?,5?,6?,7?,10-,11+ |
| InChIKey | QBYJBZPUGVGKQQ-LYSYVJQESA-N |
| Molecular Weight | 364.914 g/mol |
| Nominal Mass | 362 u |
| Number of Peaks | 105 |
| SMILES | C1C2C=CC1C1C2[C@@]2(C(=C([C@]1(C2(Cl)Cl)Cl)Cl)Cl)Cl |
| SPLASH | splash10-00ke-4950000000-cbc8c8b6b5d4ab8486ef |
| Source of Spectrum | Dr. Rolf Kuehnle |
| Synonyms | 1,8,9,10,11,11-hexachlorotetracyclo[6.2.1.1~3,6~.0~2,7~]dodeca-4,9-diene (1R,4S,4aS,5S,8R,8aR)-1,2,3,4,10,10-hexachloro-1,4,4a,5,8,8a-hexahydro-1,4:5,8-dimethanonaphthalene (1R,4S,4aS,5S,8R,8aR)-rel-1,2,3,4,10,10-hexachloro-1,4,4a,5,8,8a-hexahydro-1,4:5,8-dimethanonaphthalene |
| Technique | GC/MS |
| Wiley ID | WID_MSPA_3353 |