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3-Iodo-6,7,8,9-tetrahydro-5H-pyrido[2,3-b]indole
SpectraBase Compound ID YnkzXcTWx2
InChI InChI=1S/C11H11IN2/c12-7-5-9-8-3-1-2-4-10(8)14-11(9)13-6-7/h5-6H,1-4H2,(H,13,14)
InChIKey XNYZFJDMQJAGOS-UHFFFAOYSA-N
Mol Weight 298.13 g/mol
Molecular Formula C11H11IN2
Exact Mass 297.996693 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2VdT8Nbftna
Name 3-Iodo-6,7,8,9-tetrahydro-5H-pyrido[2,3-b]indole
Appearance Off-white powder
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Formula C11H11IN2
InChI InChI=1S/C11H11IN2/c12-7-5-9-8-3-1-2-4-10(8)14-11(9)13-6-7/h5-6H,1-4H2,(H,13,14)
InChIKey XNYZFJDMQJAGOS-UHFFFAOYSA-N
Instrument Name Finnigan MAT ITD-700
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2865
Molecular Weight 298.127 g/mol
SMILES [nH]1c2c(c3c1ncc(c3)I)CCCC2
SPLASH splash10-006t-0190000000-e0a3fbff950636c7c8ac
Source of Spectrum Y-54-2661-4a
Thin-Layer Chromatography Rf = 0.5 (CHCl3/MeOH, 20:1)
Wiley ID 1878494