| SpectraBase Compound ID | 9Efh0RjEgvv |
|---|---|
| InChI | InChI=1S/C12H9O.C12H11.C10H8.2Fe/c13-12(11-8-4-5-9-11)10-6-2-1-3-7-10;1-2-6-11(7-3-1)10-12-8-4-5-9-12;1-2-6-9(5-1)10-7-3-4-8-10;;/h1-9H;1-9H,10H2;1-8H;;/q2*-5;-10;; |
| InChIKey | YOZPSJQONBOMAW-UHFFFAOYSA-N |
| Mol Weight | 564.29 g/mol |
| Molecular Formula | C34H28Fe2O |
| Exact Mass | 564.083888 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | DxVFLQrpQD9 |
|---|---|
| Name | 1,1''-Biferrocene, 1'-benzoyl-1'''-(phenylmethyl)- |
| Alternate Name(s) | 1'-Benzoyl-1'''-benzylbiferrocene 1'-Benzoyl-1'''-benzylbiferrocene 1,1''-biferrocene, 1'-benzoyl-1'''-(phenylmethyl)- 1-Benzoylcyclopentane-1,2,3,4,5-pentaide 1-benzylcyclopentane-1,2,3,4,5-pentaide 3-(cyclopentane-1,2,3,4,5-pentaid-1-yl)cyclopentane-1,2,3,4,5-pentaide diiron Biferrocene, 1'-benzoyl-1'''-benzyl- Biferrocene, 1'-benzoyl-1'''-benzyl- |
| CAS Registry Number | 56770-55-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C34H28Fe2O |
| InChI | InChI=1S/C12H9O.C12H11.C10H8.2Fe/c13-12(11-8-4-5-9-11)10-6-2-1-3-7-10;1-2-6-11(7-3-1)10-12-8-4-5-9-12;1-2-6-9(5-1)10-7-3-4-8-10;;/h1-9H;1-9H,10H2;1-8H;;/q2*-5;-10;; |
| InChIKey | YOZPSJQONBOMAW-UHFFFAOYSA-N |
| Molecular Weight | 564.287 g/mol |
| SMILES | C(=O)([C-]1[CH-][CH-][CH-][CH-]1)c1ccccc1.[Fe].[Fe].[CH-]1[CH-][CH-][C-]([CH-]1)[C-]1[CH-][CH-][CH-][CH-]1.C([C-]1[CH-][CH-][CH-][CH-]1)c1ccccc1 |
| SPLASH | splash10-08gi-0004790000-ef862bb4070485c2a8c4 |
| Source of Spectrum | AG-93-229-0 |
| Wiley ID | 1407163 |