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Benzenepropanol, .beta.-methyl-.gamma.-(tributylstannyl)-, 4-methylbenzenesulfonate, (R*,R*)-(.+-.)-
SpectraBase Compound ID 6G52lEVI6Rt
InChI InChI=1S/C17H19O3S.3C4H9.Sn/c1-14-8-10-17(11-9-14)21(18,19)20-13-15(2)12-16-6-4-3-5-7-16;3*1-3-4-2;/h3-12,15H,13H2,1-2H3;3*1,3-4H2,2H3;
InChIKey XLKUSDUGUWIQKG-UHFFFAOYSA-N
Mol Weight 593.5 g/mol
Molecular Formula C29H46O3SSn
Exact Mass 594.218969 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HOXPRLkUBPs
Name Benzenepropanol, .beta.-methyl-.gamma.-(tributylstannyl)-, 4-methylbenzenesulfonate, (R*,R*)-(.+-.)-
CAS Registry Number 108964-65-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H46O3SSn
InChI InChI=1S/C17H19O3S.3C4H9.Sn/c1-14-8-10-17(11-9-14)21(18,19)20-13-15(2)12-16-6-4-3-5-7-16;3*1-3-4-2;/h3-12,15H,13H2,1-2H3;3*1,3-4H2,2H3;
InChIKey XLKUSDUGUWIQKG-UHFFFAOYSA-N
Molecular Weight 593.455 g/mol
SMILES C(OS(c1ccc(cc1)C)(=O)=O)C(C([Sn](CCCC)(CCCC)CCCC)c1ccccc1)C
SPLASH splash10-00lr-0920000000-75c040df674a1369029c
Source of Spectrum F-42-3188-9
Synonyms (2RS,3RS)-2-methyl-3-phenyl-3-tributylstannyl-1-propyl p-toluenesulphonate 2-Methyl-3-phenyl-3-(tributylstannyl)propyl 4-methylbenzenesulfonate
Wiley ID 1409614