SpectraBase Spectrum ID |
2tMbcMzEnh6 |
Name |
Iron, tricarbonyl[(O,1,2,3-.eta.)-1-phenyl-1-hepten-3-one]-, (E)- |
CAS Registry Number |
112515-13-6 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C16H16FeO4 |
InChI |
InChI=1S/C13H16O.3CO.Fe/c1-2-3-9-13(14)11-10-12-7-5-4-6-8-12;3*1-2;/h4-8,10-11H,2-3,9H2,1H3;;;;/q-1;;;;+1 |
InChIKey |
ATWQRBGXUKUPFZ-UHFFFAOYSA-N |
Molecular Weight |
328.145 g/mol |
SMILES |
C12([Fe]3(O2)(C1C3c1ccccc1)(C#[O])(C#[O])C#[O])CCCC |
SPLASH |
splash10-0ufr-0029000000-002a237d05f767ff5e0a |
Source of Spectrum |
KC-1988-2093-7 |
Synonyms |
1-Hepten-3-one, 1-phenyl-, iron complex, (E)-
3-Butyl-1,1,1-tris(hydroxymethyl)-5-phenyl-2-oxa-1-ferratricyclo[2.1.0.0(1,3)]pentane
Tricarbonyl(benzylidenemethyl butyl ketone)iron(0) |
Wiley ID |
1326032 |