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Tricarbonyl(2-4-eta-1,4,7-trimethyl-bicyclo[4.3.1]deca-3,7-diene-2,10-diyl]iron
SpectraBase Compound ID MoyHi14ttH
InChI InChI=1S/C13H18.3CO.Fe/c1-10-4-6-13(3)7-5-11(2)12(8-10)9-13;3*1-2;/h4-6,9,12H,7-8H2,1-3H3;;;;/q-2;;;;+2/t12-,13-;;;;/m0..../s1
InChIKey VVAKIAZKWOCZIV-FDUIRRPTSA-N
Mol Weight 314.162 g/mol
Molecular Formula C16H18FeO3
Exact Mass 314.06053 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1Euv6VmQDQ3
Name Tricarbonyl(2-4-eta-1,4,7-trimethyl-bicyclo[4.3.1]deca-3,7-diene-2,10-diyl]iron
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18FeO3
InChI InChI=1S/C13H18.3CO.Fe/c1-10-4-6-13(3)7-5-11(2)12(8-10)9-13;3*1-2;/h4-6,9,12H,7-8H2,1-3H3;;;;/q-2;;;;+2/t12-,13-;;;;/m0..../s1
InChIKey VVAKIAZKWOCZIV-FDUIRRPTSA-N
Literature Reference DOI 10.1002/hlca.19770600615
Molecular Weight 314.162 g/mol
SMILES [C@]12([CH-]C=C(C[C@](C(=CC2)C)([CH-]1)[H])C)C.[Fe+2].[O+]#[C-].[C-]#[O+].[C-]#[O+]
SPLASH splash10-08fr-3962000000-d0e4c1adf8af623d1a7e
Source of Spectrum H-60-1956-18
Wiley ID 1797384