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1-(4,5-Dihydro-4,4-dimethyl-2-oxazolyl)-2-(1-naphthyl)ferrocene
SpectraBase Compound ID 2LnK38UT0GH
InChI InChI=1S/C20H18NO.C5H5.Fe/c1-20(2)13-22-19(21-20)18-12-6-11-17(18)16-10-5-8-14-7-3-4-9-15(14)16;1-2-4-5-3-1;/h3-12H,13H2,1-2H3;1-5H;/q2*-1;+2
InChIKey FPURXQFRYZQSNB-UHFFFAOYSA-N
Mol Weight 409.31 g/mol
Molecular Formula C25H23FeNO
Exact Mass 409.1129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KVoVDJdJ8oC
Name 1-(4,5-Dihydro-4,4-dimethyl-2-oxazolyl)-2-(1-naphthyl)ferrocene
Alternate Name(s) iron(II) 3-(4,4-dimethyl-4,5-dihydrooxazol-2-yl)-2-(naphthalen-1-yl)cyclopenta-2,4-dien-1-ide cyclopenta-2,4-dien-1-ide
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Formula C25H23FeNO
InChI InChI=1S/C20H18NO.C5H5.Fe/c1-20(2)13-22-19(21-20)18-12-6-11-17(18)16-10-5-8-14-7-3-4-9-15(14)16;1-2-4-5-3-1;/h3-12H,13H2,1-2H3;1-5H;/q2*-1;+2
InChIKey FPURXQFRYZQSNB-UHFFFAOYSA-N
Molecular Weight 409.310 g/mol
SMILES [Fe+2].c1c(c([cH-]c1)-c1cccc2c1cccc2)C=1OCC(N1)(C)C.[cH-]1cccc1
SPLASH splash10-0a4r-0501900000-e817ac30e907b5a48e17
Source of Spectrum ASC-359-1388/SM13-3b
Wiley ID 1807884