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Chromium, tricarbonyl-.eta.-6-(tetracyclo[12.4.0.0(3,7).0(8,12)]octadeca-14,16,18-triene-2,13-dione)
SpectraBase Compound ID 2xVezF3xBDz
InChI InChI=1S/C18H20O2.3CO.Cr/c19-17-13-9-3-7-11(13)12-8-4-10-14(12)18(20)16-6-2-1-5-15(16)17;3*1-2;/h1-2,5-6,11-14H,3-4,7-10H2;;;;
InChIKey QYBIEQYFGTWNNA-UHFFFAOYSA-N
Mol Weight 400.35 g/mol
Molecular Formula C21H16CrO5
Exact Mass 400.040279 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GatRUJJpaRm
Name Chromium, tricarbonyl-.eta.-6-(tetracyclo[12.4.0.0(3,7).0(8,12)]octadeca-14,16,18-triene-2,13-dione)
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Formula C21H20CrO5
InChI InChI=1S/C18H20O2.3CO.Cr/c19-17-13-9-3-7-11(13)12-8-4-10-14(12)18(20)16-6-2-1-5-15(16)17;3*1-2;/h1-2,5-6,11-14H,3-4,7-10H2;;;;
InChIKey QYBIEQYFGTWNNA-UHFFFAOYSA-N
Molecular Weight 400.350 g/mol
SMILES [Cr].C1CC2C(C3C(C([C]4[C]([C][C][C][C]4)C2=O)=O)CCC3)C1.[O+]#[C-].[C-]#[O+].[C-]#[O+]
SPLASH splash10-00di-4339000000-ac752ccabc236f25563c
Wiley ID 1492729