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5-mesyl-7,8,9,10,11,12-hexahydro-6H-cyclonon[b]indole
SpectraBase Compound ID CDPqN9vGpDP
InChI InChI=1S/C16H21NO2S/c1-20(18,19)17-15-11-6-4-2-3-5-9-13(15)14-10-7-8-12-16(14)17/h7-8,10,12H,2-6,9,11H2,1H3
InChIKey NSBOPQODQMRLCK-UHFFFAOYSA-N
Mol Weight 291.41 g/mol
Molecular Formula C16H21NO2S
Exact Mass 291.1293 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID A1LuMj0A4uB
Name 5-mesyl-7,8,9,10,11,12-hexahydro-6H-cyclonon[b]indole
Alternate Name(s) 5-methylsulfonyl-7,8,9,10,11,12-hexahydro-6H-cyclonona[b]indole
Comments Less than 3 mono-isotopic peaks
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Formula C16H21NO2S
InChI InChI=1S/C16H21NO2S/c1-20(18,19)17-15-11-6-4-2-3-5-9-13(15)14-10-7-8-12-16(14)17/h7-8,10,12H,2-6,9,11H2,1H3
InChIKey NSBOPQODQMRLCK-UHFFFAOYSA-N
Molecular Weight 291.409 g/mol
SMILES CS([n]1c2c(CCCCCCC2)c2c1cccc2)(=O)=O
SPLASH splash10-03dl-0090000000-3dadd387a080cadd5ad8
Source of Spectrum KC-0-2406-24
Wiley ID 831388