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Benzeneacetonitrile, .alpha.-butyl-3,4-dimethoxy-.alpha.-[(tributylstannyl)methyl]-
SpectraBase Compound ID KlgeKG8xpGD
InChI InChI=1S/C15H20NO2.3C4H9.Sn/c1-5-6-9-15(2,11-16)12-7-8-13(17-3)14(10-12)18-4;3*1-3-4-2;/h7-8,10H,2,5-6,9H2,1,3-4H3;3*1,3-4H2,2H3;
InChIKey FJQJQEWSSRSGSH-UHFFFAOYSA-N
Mol Weight 536.4 g/mol
Molecular Formula C27H47NO2Sn
Exact Mass 537.262882 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IXwNJHUHx7K
Name Benzeneacetonitrile, .alpha.-butyl-3,4-dimethoxy-.alpha.-[(tributylstannyl)methyl]-
Alternate Name(s) 2-(3,4-dimethoxyphenyl)-2-[(tributylstannyl)methyl]hexanenitrile
CAS Registry Number 97415-99-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H47NO2Sn
InChI InChI=1S/C15H20NO2.3C4H9.Sn/c1-5-6-9-15(2,11-16)12-7-8-13(17-3)14(10-12)18-4;3*1-3-4-2;/h7-8,10H,2,5-6,9H2,1,3-4H3;3*1,3-4H2,2H3;
InChIKey FJQJQEWSSRSGSH-UHFFFAOYSA-N
Molecular Weight 536.389 g/mol
SMILES C(c1cc(OC)c(cc1)OC)(C#N)(C[Sn](CCCC)(CCCC)CCCC)CCCC
SPLASH splash10-00du-0090300000-4e40f05d4dc875abbda8
Source of Spectrum J-50-3626-4
Wiley ID 1404207