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4-(4-methylphenyl)sulfonyl-2,3-dihydro-1H-cyclopenta[b]indole
SpectraBase Compound ID 5lTnQkb7rqk
InChI InChI=1S/C18H17NO2S/c1-13-9-11-14(12-10-13)22(20,21)19-17-7-3-2-5-15(17)16-6-4-8-18(16)19/h2-3,5,7,9-12H,4,6,8H2,1H3
InChIKey IDAAOTGUJWNADE-UHFFFAOYSA-N
Mol Weight 311.4 g/mol
Molecular Formula C18H17NO2S
Exact Mass 311.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FGJDQ6h9wKa
Name 4-(4-methylphenyl)sulfonyl-2,3-dihydro-1H-cyclopenta[b]indole
Alternate Name(s) 4-(p-tolylsulfonyl)-2,3-dihydro-1H-cyclopenta[b]indole 4-tosyl-2,3-dihydro-1H-cyclopent[b]indole
Comments Less than 3 mono-isotopic peaks
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Formula C18H17NO2S
InChI InChI=1S/C18H17NO2S/c1-13-9-11-14(12-10-13)22(20,21)19-17-7-3-2-5-15(17)16-6-4-8-18(16)19/h2-3,5,7,9-12H,4,6,8H2,1H3
InChIKey IDAAOTGUJWNADE-UHFFFAOYSA-N
Molecular Weight 311.399 g/mol
SMILES c12[n](c3ccccc3c2CCC1)S(=O)(=O)c1ccc(cc1)C
SPLASH splash10-0bt9-0906000000-94cf2840dff67206d8f5
Source of Spectrum F-69-1135-21
Wiley ID 1594690