SpectraBase Spectrum ID |
FZa0tLjXjyG |
Name |
(Rp)-(2-Methylferrocenyl)-(Sp)-[2-(methylsulfanyl)ferrocenyl]-methanone |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C23H22Fe2OS |
InChI |
InChI=1S/C13H12OS.2C5H5.2Fe/c1-9-5-3-6-10(9)13(14)11-7-4-8-12(11)15-2;2*1-2-4-5-3-1;;/h3-8H,1-2H3;2*1-5H;; |
InChIKey |
QMVMQVSLMLQAMQ-UHFFFAOYSA-N |
Molecular Weight |
458.178 g/mol |
SMILES |
C12([Fe]3456789(C2C5C4C13SC)C1C6C7C8C91)C(C12[Fe]3456789(C%10C7C6C5C3%10)C1C9C4C28C)=O |
SPLASH |
splash10-002f-0000900000-c3dd478dc66e04df3bb4 |
Source of Spectrum |
U1-2009-2154-7a |
Wiley ID |
1662869 |