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4,4-Dimethyl-2-(tributylstannyl)methylcyclohex-2-en-1-one
SpectraBase Compound ID JvLQI9im0kA
InChI InChI=1S/C9H13O.3C4H9.Sn/c1-7-6-9(2,3)5-4-8(7)10;3*1-3-4-2;/h6H,1,4-5H2,2-3H3;3*1,3-4H2,2H3;
InChIKey IZYPFJPQQGFEGM-UHFFFAOYSA-N
Mol Weight 427.3 g/mol
Molecular Formula C21H40OSn
Exact Mass 428.210118 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EbmieTF7EYU
Name 4,4-Dimethyl-2-(tributylstannyl)methylcyclohex-2-en-1-one
Appearance Yellow oil
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Exact Mass 428.210117907 u
Formula C21H40OSn
InChI InChI=1S/C9H13O.3C4H9.Sn/c1-7-6-9(2,3)5-4-8(7)10;3*1-3-4-2;/h6H,1,4-5H2,2-3H3;3*1,3-4H2,2H3;
InChIKey IZYPFJPQQGFEGM-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS-QP2010SE
Ionization Type EI
Literature Reference DOI 10.1002/chem.201601515
Molecular Weight 427.261 g/mol
Quality 21
Reported Formula C21H40OSn
SMILES C([Sn](CCCC)(CCCC)CCCC)C=1C(CCC(C1)(C)C)=O
SPLASH splash10-00di-0229000000-2654d8a0f15914d6c462
Source of Spectrum QE-22-SM6-2h (DOI: 10.1002/chem.201601515)
Wiley ID 1903467