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1,1''-Biferrocene, 1',1'''-bis(hydroxyphenylmethyl)-
SpectraBase Compound ID BtLHaOqWBnp
InChI InChI=1S/2C12H11O.C10H8.2Fe/c2*13-12(11-8-4-5-9-11)10-6-2-1-3-7-10;1-2-6-9(5-1)10-7-3-4-8-10;;/h2*1-9,12-13H;1-8H;;/q2*-5;-10;;
InChIKey YIWITAMZPAVHKR-UHFFFAOYSA-N
Mol Weight 582.3 g/mol
Molecular Formula C34H30Fe2O2
Exact Mass 582.094452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID C4R2egoLW3O
Name 1,1''-Biferrocene, 1',1'''-bis(hydroxyphenylmethyl)-
Alternate Name(s) 1',1'''-bis(.alpha.-hydroxybenzyl)biferrocene 1',1'''-Bis(.alpha.-hydroxybenzyl)biferrocene 1,1''-biferrocene, 1',1'''-bis(hydroxyphenylmethyl)- Biferrocene, 1',1'''-bis(.alpha.-hydroxybenzyl)- Biferrocene, 1',1'''-bis(.alpha.-hydroxybenzyl)- bis(1-[hydroxy(phenyl)methyl]cyclopentane-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 56770-52-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C34H30Fe2O2
InChI InChI=1S/2C12H11O.C10H8.2Fe/c2*13-12(11-8-4-5-9-11)10-6-2-1-3-7-10;1-2-6-9(5-1)10-7-3-4-8-10;;/h2*1-9,12-13H;1-8H;;/q2*-5;-10;;
InChIKey YIWITAMZPAVHKR-UHFFFAOYSA-N
Molecular Weight 582.302 g/mol
SMILES OC([C-]1[CH-][CH-][CH-][CH-]1)c1ccccc1.[Fe].[Fe].[CH-]1[CH-][CH-][C-]([CH-]1)[C-]1[CH-][CH-][CH-][CH-]1.OC([C-]1[CH-][CH-][CH-][CH-]1)c1ccccc1
SPLASH splash10-0r0r-0006690000-dfe1b518498e99a188e2
Source of Spectrum O-11-36-1
Wiley ID 1408668