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5-(p-Toluenesulfonyloxymethyl)indolizidine

View entire compound with spectra: 1 MS (GC)

5-(p-Toluenesulfonyloxymethyl)indolizidine
SpectraBase Compound ID E6jNLrJCkiA
InChI InChI=1S/C16H23NO3S/c1-13-7-9-16(10-8-13)21(18,19)20-12-15-5-2-4-14-6-3-11-17(14)15/h7-10,14-15H,2-6,11-12H2,1H3/t14-,15+/m1/s1
InChIKey VBOKPXKMEKYUKA-CABCVRRESA-N
Mol Weight 309.42 g/mol
Molecular Formula C16H23NO3S
Exact Mass 309.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4AieUsW9kQS
Name 5-(p-Toluenesulfonyloxymethyl)indolizidine
Alternate Name(s) 4-methylbenzenesulfonic acid [(5S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]methyl ester [(5S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]methyl 4-methylbenzenesulfonate
Comments Less than 3 mono-isotopic peaks
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Formula C16H23NO3S
InChI InChI=1S/C16H23NO3S/c1-13-7-9-16(10-8-13)21(18,19)20-12-15-5-2-4-14-6-3-11-17(14)15/h7-10,14-15H,2-6,11-12H2,1H3/t14-,15+/m1/s1
InChIKey VBOKPXKMEKYUKA-CABCVRRESA-N
Molecular Weight 309.424 g/mol
SMILES C(OS(c1ccc(cc1)C)(=O)=O)[C@]1(N2[C@](CCC2)([H])CCC1)[H]
SPLASH splash10-00di-0900000000-b7f70bb01ebb2cf7d194
Source of Spectrum F-69-3100-12
Wiley ID 1594964