| SpectraBase Spectrum ID |
FAVgGtQLU6y |
| Name |
(h5-cyclopentadienyl)dicarbonyl 1-S-neomenthylacetyliron |
| Alternate Name(s) |
1-[1,1-bis(hydroxymethyl)-1-ferrapentacyclo[2.2.0.0(1,3).0(1,5).0(2,6)]hexan-1-yl]-2-[5-methyl-2-(propan-2-yl)-5-sulfanylcyclohexyl]ethan-1-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H26FeO3S |
| InChI |
InChI=1S/C12H21OS.C5H5.2CO.Fe/c1-9(2)11-4-6-12(3,14)8-10(11)5-7-13;1-2-4-5-3-1;2*1-2;/h9-11,14H,4-6,8H2,1-3H3;1-5H;;; |
| InChIKey |
CRPVMSXWBDOFLZ-UHFFFAOYSA-N |
| Molecular Weight |
390.319 g/mol |
| SMILES |
SC1(CC(CC([Fe]2345([C@]6([C@@]5([C@@]4([C@@]2([C@@]36[H])[H])[H])[H])[H])(C#[O])C#[O])=O)C(CC1)C(C)C)C |
| SPLASH |
splash10-0a4i-6690000000-7432d3cea2769f98082d |
| Source of Spectrum |
O-30-160-1 |
| Wiley ID |
1364677 |
