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(1-trityl-3-piperidyl)methyl 4-methylbenzenesulfonate
SpectraBase Compound ID DByAkjGu0kB
InChI InChI=1S/C32H33NO3S/c1-26-19-21-31(22-20-26)37(34,35)36-25-27-12-11-23-33(24-27)32(28-13-5-2-6-14-28,29-15-7-3-8-16-29)30-17-9-4-10-18-30/h2-10,13-22,27H,11-12,23-25H2,1H3
InChIKey QIFFYMRALAXJJU-UHFFFAOYSA-N
Mol Weight 511.7 g/mol
Molecular Formula C32H33NO3S
Exact Mass 511.218115 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1iZOazQjwt5
Name (1-trityl-3-piperidyl)methyl 4-methylbenzenesulfonate
Alternate Name(s) (1-tritylpiperidin-3-yl)methyl 4-methylbenzenesulfonate 4-Methylbenzenesulfonic acid (1-trityl-3-piperidyl)methyl ester [1-(triphenylmethyl)piperidin-3-yl]methyl 4-methylbenzenesulfonate
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Formula C32H33NO3S
InChI InChI=1S/C32H33NO3S/c1-26-19-21-31(22-20-26)37(34,35)36-25-27-12-11-23-33(24-27)32(28-13-5-2-6-14-28,29-15-7-3-8-16-29)30-17-9-4-10-18-30/h2-10,13-22,27H,11-12,23-25H2,1H3
InChIKey QIFFYMRALAXJJU-UHFFFAOYSA-N
Molecular Weight 511.680 g/mol
SMILES c1(S(OCC2CN(C(c3ccccc3)(c3ccccc3)c3ccccc3)CCC2)(=O)=O)ccc(cc1)C
SPLASH splash10-0006-0290000000-79a68244e35f918b1a42
Source of Spectrum F2-41-1938-19
Wiley ID 1599652