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2-Methyl-8-tosyl-8-azabicyclo[4.3.0]non-9-ene
SpectraBase Compound ID Lralwy2gyZ1
InChI InChI=1S/C16H21NO2S/c1-12-6-8-15(9-7-12)20(18,19)17-10-14-5-3-4-13(2)16(14)11-17/h6-9,11,13-14H,3-5,10H2,1-2H3
InChIKey HUJGHQAZNTZVDJ-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 5QsUxFQzyFu
Name 2-Methyl-8-tosyl-8-azabicyclo[4.3.0]non-9-ene
Alternate Name(s) 3-Methyl-5-(toluene-4-sulfonyl)-2,4,5,6,7,7a-hexahydro-1H-pyrrolo[3,4-c]pyridine 4-Methyl-2-[(4-methylphenyl)sulfonyl]-2,4,5,6,7,7a-hexahydro-1H-isoindole
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Formula C16H21NO2S
InChI InChI=1S/C16H21NO2S/c1-12-6-8-15(9-7-12)20(18,19)17-10-14-5-3-4-13(2)16(14)11-17/h6-9,11,13-14H,3-5,10H2,1-2H3
InChIKey HUJGHQAZNTZVDJ-UHFFFAOYSA-N
Molecular Weight 291.409 g/mol
SMILES C=1N(S(c2ccc(cc2)C)(=O)=O)CC2CCCC(C12)C
SPLASH splash10-054x-7940000000-d5df2c4b51dd11fa1075
Source of Spectrum J-58-5460-26
Wiley ID 1294539