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4-(Tert-butyl)-1-(3-triphenylstannylpropyl)-1,3-cyclopentadiene

View entire compound with spectra: 1 NMR, and 1 MS (GC)

4-(Tert-butyl)-1-(3-triphenylstannylpropyl)-1,3-cyclopentadiene
SpectraBase Compound ID CUm1BHpG3PA
InChI InChI=1S/C12H19.3C6H5.Sn/c1-5-6-10-7-8-11(9-10)12(2,3)4;3*1-2-4-6-5-3-1;/h7-8H,1,5-6,9H2,2-4H3;3*1-5H;
InChIKey CNRFWFXMCITYNI-UHFFFAOYSA-N
Mol Weight 513.3 g/mol
Molecular Formula C30H34Sn
Exact Mass 514.168253 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID BrUfLQPzW5S
Name 4-(Tert-butyl)-1-(3-triphenylstannylpropyl)-1,3-cyclopentadiene
Comments Computed using HOSE algorithm
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Exact Mass 514.168253095 u
Formula C30H34Sn
InChI InChI=1S/C12H19.3C6H5.Sn/c1-5-6-10-7-8-11(9-10)12(2,3)4;3*1-2-4-6-5-3-1;/h7-8H,1,5-6,9H2,2-4H3;3*1-5H;
InChIKey CNRFWFXMCITYNI-UHFFFAOYSA-N
Molecular Weight 513.313 g/mol
SMILES C1(=CC=C(C1)C(C)(C)C)CCC[Sn](C=1C=CC=CC1)(C=1C=CC=CC1)C=1C=CC=CC1