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1-Benzylidene-5,6-butano-7-azaindane
SpectraBase Compound ID 11rGliQcGQr
InChI InChI=1S/C19H19N/c1-2-6-14(7-3-1)12-16-10-11-17-13-15-8-4-5-9-18(15)20-19(16)17/h1-3,6-7,12-13H,4-5,8-11H2/b16-12+
InChIKey IZYQKLNPQYQTDG-FOWTUZBSSA-N
Mol Weight 261.37 g/mol
Molecular Formula C19H19N
Exact Mass 261.15175 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JH54ux1ewG3
Name 1-Benzylidene-5,6-butano-7-azaindane
Alternate Name(s) (3E)-3-benzylidene-2,3,5,6,7,8-hexahydro-1H-cyclopenta[b]quinoline
Comments Less than 3 mono-isotopic peaks
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Formula C19H19N
InChI InChI=1S/C19H19N/c1-2-6-14(7-3-1)12-16-10-11-17-13-15-8-4-5-9-18(15)20-19(16)17/h1-3,6-7,12-13H,4-5,8-11H2/b16-12+
InChIKey IZYQKLNPQYQTDG-FOWTUZBSSA-N
Molecular Weight 261.368 g/mol
SMILES c12nc3c(cc1CC\C2=C\c1ccccc1)CCCC3
SPLASH splash10-03e9-0090000000-f87b299bbfca2f8a29f8
Source of Spectrum O1-29-245-17
Wiley ID 818456