| SpectraBase Spectrum ID |
JX786GrS87i |
| Name |
1,3-Cyclohexadiene, 5-methyl-, iron complex |
| CAS Registry Number |
83603-13-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C10H10FeO3 |
| InChI |
InChI=1S/C7H10.3CO.Fe/c1-7-5-3-2-4-6-7;3*1-2;/h2-5,7H,6H2,1H3;;;; |
| InChIKey |
GAEJKCMICUJGAF-UHFFFAOYSA-N |
| Molecular Weight |
234.032 g/mol |
| SMILES |
[C@]12([Fe]34([C@]2(C(C)C[C@@]4([C@]13[H])[H])[H])(C#[O])(C#[O])C#[O])[H] |
| SPLASH |
splash10-001i-0910000000-f38a880cd21bd04f0440 |
| Source of Spectrum |
KC-1982-2453-0 |
| Synonyms |
Iron, tricarbonyl[(1,2,3,4-.eta.)-5-methyl-1,3-cyclohexadiene]-, stereoisomer
1,1,1-tris(hydroxymethyl)-3-methyl-1-ferratetracyclo[3.2.0.0(1,6).0(2,7)]heptane
Tricarbonyl(1-4-.eta.-5.beta.-methylcyclohexa-1,3-diene)-iron(0) |
| Wiley ID |
1235494 |
