![Iron, [.eta.4-2,3-bis(methylene)-7-oxabicyclo[2.2.1]heptane]tricarbonyl-, stereoisomer](/api/spectrum/968deSeOkue/structure.png?h=300&w=458 "Iron, [.eta.4-2,3-bis(methylene)-7-oxabicyclo[2.2.1]heptane]tricarbonyl-, stereoisomer")
| SpectraBase Compound ID | 6Q6S5jueonI |
|---|---|
| InChI | InChI=1S/C8H10O.3CO.Fe/c1-5-6(2)8-4-3-7(5)9-8;3*1-2;/h7-8H,1-4H2;;;;/t7-,8+;;;; |
| InChIKey | DOPCJJBTGQDFFG-XFOIBMPCSA-N |
| Mol Weight | 262.04 g/mol |
| Molecular Formula | C11H10FeO4 |
| Exact Mass | 261.992845 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 968deSeOkue |
|---|---|
| Name | Iron, [.eta.4-2,3-bis(methylene)-7-oxabicyclo[2.2.1]heptane]tricarbonyl-, stereoisomer |
| CAS Registry Number | 94536-74-0 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C11H10FeO4 |
| InChI | InChI=1S/C8H10O.3CO.Fe/c1-5-6(2)8-4-3-7(5)9-8;3*1-2;/h7-8H,1-4H2;;;;/t7-,8+;;;; |
| InChIKey | DOPCJJBTGQDFFG-XFOIBMPCSA-N |
| Molecular Weight | 262.042 g/mol |
| SMILES | [C@@]123[Fe]4([C@@]2([C@]2(O[C@@]3(CC2)[H])[H])C4)(C1)(C#[O])(C#[O])C#[O] |
| SPLASH | splash10-0kl0-0920000000-a3a56fd5f8956ebfef79 |
| Source of Spectrum | H-67-1644-0 |
| Synonyms | (1R,2R,6S,7S)-4,4,4-tris(hydroxymethyl)-10-oxa-4-ferrapentacyclo[5.2.1.0(2,4).0(2,6).0(4,6)]decane 7-Oxabicyclo[2.2.1]heptane, 2,3-bis(methylene)-, iron complex Tricarbonyl[(1R,2S,3S,4S)-C,2,3,C-.eta.-(2,3-dimethylidene-7-oxabicyclo[2.2.1]heptane)iron (endo isomer) Tricarbonyl[(1R,2S,3R,4S)-c,2,3,c-.eta.-(2,3-dimethylidene-7-oxabicyclo[2.2.1]heptane)iron (exo isomer) |
| Wiley ID | 1265305 |