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Penracarbonyl-{5-[(3'-Butyn-2'-yloxy)phenyl]-1-methoxypentenylidene}-chromium
SpectraBase Compound ID 3BwrhOpf9Ge
InChI InChI=1S/C16H18O2.5CO.Cr/c1-3-4-14-18-16-12-8-7-11-15(16)10-6-5-9-13-17-2;5*1-2;/h5,7-9,11-12H,6,10,14H2,1-2H3;;;;;;/b9-5+;;;;;;
InChIKey HVZDJXRTLMMMRN-DQSDWSSWSA-N
Mol Weight 434.36 g/mol
Molecular Formula C21H18CrO7
Exact Mass 434.045758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K3zM7LD70yE
Name Penracarbonyl-{5-[(3'-Butyn-2'-yloxy)phenyl]-1-methoxypentenylidene}-chromium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18CrO7
InChI InChI=1S/C16H18O2.5CO.Cr/c1-3-4-14-18-16-12-8-7-11-15(16)10-6-5-9-13-17-2;5*1-2;/h5,7-9,11-12H,6,10,14H2,1-2H3;;;;;;/b9-5+;;;;;;
InChIKey HVZDJXRTLMMMRN-DQSDWSSWSA-N
Molecular Weight 434.364 g/mol
SMILES C([Cr](C#[O])(C#[O])(C#[O])(C#[O])=C(\C=C\CCc1c(OCC#CC)cccc1)OC)#[O]
SPLASH splash10-0udj-9630000000-75cd4dee8689ce3f10e4
Source of Spectrum K1-2002-46-1
Synonyms Penracarbonyl-{5-[(2'-Butyn-4'-yloxy)phenyl]-1-methoxypentenylidene}-chromium Pentacarbonyl-{5-[(2'-Butyn-1'-yloxy)phenyl]-1-methoxypentenylidene}-chromium {(E)-5-[(2-Butyn-1-yloxy)phenyl]-1-methoxypent-2-enylidene}pentacarbonylchromium {(E)-5-[(2-Butyn-4-yloxy)phenyl]-1-methoxypent-2-enylidene}pentacarbonylchromium {(E)-5-[(3-Butyn-2-yloxy)phenyl]-1-methoxypent-2-enylidene}pentacarbonylchromium
Wiley ID 871950