| SpectraBase Spectrum ID |
7dXQCs72Kh0 |
| Name |
Tricarbonyl(1.beta.-cyano-1.alpha.-methylcyclohexa-2,4-diene)iron |
| CAS Registry Number |
94570-58-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H9FeNO3 |
| InChI |
InChI=1S/C8H9N.3CO.Fe/c1-8(7-9)5-3-2-4-6-8;3*1-2;/h2-5H,6H2,1H3;;;;/t8-;;;;/m0..../s1 |
| InChIKey |
MZLLZSRXGFAFJP-USHJOAKVSA-N |
| Molecular Weight |
259.042 g/mol |
| SMILES |
C12[Fe]34(C2[C@@](C#N)(C)CC4C13)(C#[O])(C#[O])C#[O] |
| SPLASH |
splash10-0002-0920000000-4b7d8f4521656f98fde2 |
| Source of Spectrum |
J-50-714-0 |
| Synonyms |
(3S)-1,1,1-tris(hydroxymethyl)-3-methyl-1-ferratetracyclo[3.2.0.0(1,6).0(2,7)]heptane-3-carbonitrile |
| Wiley ID |
1262490 |
