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6-tert-Butyl-3-iodo-6,7,8,9-tetrahydro-5H-pyrido[2,3-b]indole
SpectraBase Compound ID 5zRBgTqkGLo
InChI InChI=1S/C15H19IN2/c1-15(2,3)9-4-5-13-11(6-9)12-7-10(16)8-17-14(12)18-13/h7-9H,4-6H2,1-3H3,(H,17,18)
InChIKey GOQTWADRFAFISQ-UHFFFAOYSA-N
Mol Weight 354.24 g/mol
Molecular Formula C15H19IN2
Exact Mass 354.059294 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1SoXUccBfs
Name 6-tert-Butyl-3-iodo-6,7,8,9-tetrahydro-5H-pyrido[2,3-b]indole
Appearance Pale gravel powder
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Formula C15H19IN2
InChI InChI=1S/C15H19IN2/c1-15(2,3)9-4-5-13-11(6-9)12-7-10(16)8-17-14(12)18-13/h7-9H,4-6H2,1-3H3,(H,17,18)
InChIKey GOQTWADRFAFISQ-UHFFFAOYSA-N
Instrument Name Finnigan MAT ITD-700
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2865
Molecular Weight 354.235 g/mol
SMILES [nH]1c2c(c3c1ncc(c3)I)CC(CC2)C(C)(C)C
SPLASH splash10-0fk9-1296000000-3f52737b3e08b7015fd6
Source of Spectrum Y-54-2661-4c
Thin-Layer Chromatography Rf = 0.6 (CHCl3/MeOH, 20:1)
Wiley ID 1878496