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1-(Toluene-4-sulfonyl)-1,2,3,7b-tetrahydro-1,1a-diazacyclopropa[a]naphthalene
SpectraBase Compound ID 7leipL591Hi
InChI InChI=1S/C16H16N2O2S/c1-12-6-8-14(9-7-12)21(19,20)18-16-15-5-3-2-4-13(15)10-11-17(16)18/h2-9,16H,10-11H2,1H3
InChIKey HTCYQJSBJVAJKS-UHFFFAOYSA-N
Mol Weight 300.38 g/mol
Molecular Formula C16H16N2O2S
Exact Mass 300.093249 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1J1zeT62sVP
Name 1-(Toluene-4-sulfonyl)-1,2,3,7b-tetrahydro-1,1a-diazacyclopropa[a]naphthalene
Comments Less than 3 mono-isotopic peaks
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Formula C16H16N2O2S
InChI InChI=1S/C16H16N2O2S/c1-12-6-8-14(9-7-12)21(19,20)18-16-15-5-3-2-4-13(15)10-11-17(16)18/h2-9,16H,10-11H2,1H3
InChIKey HTCYQJSBJVAJKS-UHFFFAOYSA-N
Molecular Weight 300.376 g/mol
SMILES C1N2N(C2c2c(C1)cccc2)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-0002-0902000000-f3884af44e93b426ef6f
Source of Spectrum F4-39-3690-7
Wiley ID 1670065