| SpectraBase Spectrum ID |
FM11ierTN6S |
| Name |
Ferrocene, 1-cyano-3-(methoxycarbonyl)-, stereoisomer |
| CAS Registry Number |
64444-55-9 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H11FeNO2 |
| InChI |
InChI=1S/C8H6NO2.C5H5.Fe/c1-11-8(10)7-3-2-6(4-7)5-9;1-2-4-5-3-1;/h2-4H,1H3;1-5H;/q2*-5; |
| InChIKey |
LYFSZTUKVSRPSE-UHFFFAOYSA-N |
| Molecular Weight |
269.081 g/mol |
| SMILES |
COC(=O)[C-]1[CH-][CH-][C-]([CH-]1)C#N.[Fe].[CH-]1[CH-][CH-][CH-][CH-]1 |
| SPLASH |
splash10-00di-2940000000-87eb4ff59cea62368f96 |
| Source of Spectrum |
O-20-108-12 |
| Synonyms |
3-cyano-1-[methoxy(oxo)methane]cyclopentane-1,2,3,4,5-pentaide cyclopentane-1,2,3,4,5-pentaide iron
Methyl 3-cyano-1-ferrocenecarboxylate |
| Wiley ID |
1273066 |
