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Heptyl (phenylselenyl) ketone
SpectraBase Compound ID Dkd6754W4su
InChI InChI=1S/C14H20OSe/c1-2-3-4-5-9-12-14(15)16-13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12H2,1H3
InChIKey JRFFKMNCTIIWGR-UHFFFAOYSA-N
Mol Weight 283.28 g/mol
Molecular Formula C14H20OSe
Exact Mass 284.067937 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8Gxt1DcsJHR
Name Heptyl (phenylselenyl) ketone
Comments Computed using HOSE algorithm
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Exact Mass 284.067937263 u
Formula C14H20OSe
InChI InChI=1S/C14H20OSe/c1-2-3-4-5-9-12-14(15)16-13-10-7-6-8-11-13/h6-8,10-11H,2-5,9,12H2,1H3
InChIKey JRFFKMNCTIIWGR-UHFFFAOYSA-N
Molecular Weight 283.285 g/mol
SMILES C([Se]C1=CC=CC=C1)(=O)CCCCCCC