| SpectraBase Spectrum ID |
2yEBSzBfm4 |
| Name |
Methyl (trans)-(ferrocenyl)cyclohexane-1-carboxylate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H24FeO2 |
| InChI |
InChI=1S/C14H19O2.C5H5.Fe/c1-16-14(15)13-9-5-4-8-12(13)10-11-6-2-3-7-11;1-2-4-5-3-1;/h2-3,6-7,12-13H,4-5,8-10H2,1H3;1-5H;/t12-,13+;;/m1../s1 |
| InChIKey |
RKKNSTCMXXGCTB-VAALMUBNSA-N |
| Molecular Weight |
340.244 g/mol |
| SMILES |
[C@]12([Fe]3456789([C@@]2([C@]5([C@]4([C@@]13[H])[H])[H])[H])[C@]1([C@@]6([C@@]7([C@@]8([C@@]91[H])[H])[H])[H])[H])C[C@@]1([C@@](C(=O)OC)(CCCC1)[H])[H] |
| SPLASH |
splash10-000x-5903000000-c7fd0d4086facd299c6b |
| Source of Spectrum |
AH-1333-1006-14 |
| Wiley ID |
1546684 |
