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1,1''-Biferrocene, 1',1'''-bis(phenylmethyl)-
SpectraBase Compound ID EDvzCRWmLdl
InChI InChI=1S/2C12H11.C10H8.2Fe/c2*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;;/h2*1-9H,10H2;1-8H;;/q2*-5;-10;;
InChIKey XZIQUMQMKBNCOI-UHFFFAOYSA-N
Mol Weight 550.3 g/mol
Molecular Formula C34H30Fe2
Exact Mass 550.104623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJWtuq5Who
Name 1,1''-Biferrocene, 1',1'''-bis(phenylmethyl)-
Alternate Name(s) 1',1'''-dibenzylbiferrocene 1',1'''-Dibenzylbiferrocene 1,1''-biferrocene, 1',1'''-bis(phenylmethyl)- Biferrocene, 1',1'''-dibenzyl- Biferrocene, 1',1'''-dibenzyl- bis(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
CAS Registry Number 56770-50-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H30Fe2
InChI InChI=1S/2C12H11.C10H8.2Fe/c2*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;;/h2*1-9H,10H2;1-8H;;/q2*-5;-10;;
InChIKey XZIQUMQMKBNCOI-UHFFFAOYSA-N
Molecular Weight 550.304 g/mol
SMILES C([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 splash10-0udi-0003090000-d30f62d3b0ee7828c6d0
Source of Spectrum AG-93-228-0
Wiley ID 1405767