| SpectraBase Compound ID | BS8MGG7ZHMZ |
|---|---|
| InChI | InChI=1S/C9H11O2.C5H5.Fe/c10-8-4-5-9(11)7-3-1-2-6(7)8;1-2-4-5-3-1;/h1-3,8-11H,4-5H2;1-5H;/q2*-5; |
| InChIKey | JJMYMTCRXHPLRG-UHFFFAOYSA-N |
| Mol Weight | 272.13 g/mol |
| Molecular Formula | C14H16FeO2 |
| Exact Mass | 272.049966 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JtJ93zHQnfZ |
|---|---|
| Name | Iron, .pi.-cyclopentadienyl(4,5,6,7-tetrahydro-4,7-dihydroxy-.pi.-indenyl)-,endo,endo- |
| CAS Registry Number | 12127-09-2 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C14H16FeO2 |
| InChI | InChI=1S/C9H11O2.C5H5.Fe/c10-8-4-5-9(11)7-3-1-2-6(7)8;1-2-4-5-3-1;/h1-3,8-11H,4-5H2;1-5H;/q2*-5; |
| InChIKey | JJMYMTCRXHPLRG-UHFFFAOYSA-N |
| Molecular Weight | 272.125 g/mol |
| SMILES | OC1CCC([C-]2[CH-][CH-][CH-][C-]12)O.[Fe].[CH-]1[CH-][CH-][CH-][CH-]1 |
| SPLASH | splash10-01bi-1980000000-93838e0b2e1c8f6d09e0 |
| Source of Spectrum | T-66-1277-0 |
| Synonyms | Iron, .pi.-cyclopentadienyl(4,5,6,7-tetrahydro-4,7-dihydroxy-5-phenyl-.pi.-indenyl)-, endo,exo- 4,7-Dihydroxy-octahydro-1H-indene-1,2,3,3a,7a-pentaide cyclopentane-1,2,3,4,5-pentaide iron endo/endo-1,2-(.alpha.-.delta.-dihydroxy-tetramethylene)-ferrocene endo/exo-1,2-(.alpha.,.delta.-dihydroxy-tetramethylene)-ferrocene Iron, .pi.-cyclopentadienyl(4,5,6,7-tetrahydro-4,7-dihydroxy-.pi.-indenyl)-, endo,endo- Iron, pi-cyclopentadienyl(4,5,6,7-tetrahydro-4,7-dihydroxy-5-phenyl-pi-indenyl)-, endo,exo- Iron, pi-cyclopentadienyl(4,5,6,7-tetrahydro-4,7-dihydroxy-pi-indenyl)-, endo,endo- |
| Wiley ID | 1275989 |