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4-(4-Chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-4-phenylbutan-2-one
SpectraBase Compound ID 4OBDCjKDlXP
InChI InChI=1S/C17H15ClN2O/c1-11(21)9-13(12-5-3-2-4-6-12)14-10-20-17-16(14)15(18)7-8-19-17/h2-8,10,13H,9H2,1H3,(H,19,20)
InChIKey GLNZXBMOZIDWRI-UHFFFAOYSA-N
Mol Weight 298.77 g/mol
Molecular Formula C17H15ClN2O
Exact Mass 298.087291 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DFkCjwBevjl
Name 4-(4-Chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-4-phenylbutan-2-one
Alternate Name(s) 4-(4-chloranyl-1H-pyrrolo[2,3-b]pyridin-3-yl)-4-phenyl-butan-2-one 4-(4-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-4-phenyl-2-butanone
Comments Less than 3 mono-isotopic peaks
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Formula C17H15ClN2O
InChI InChI=1S/C17H15ClN2O/c1-11(21)9-13(12-5-3-2-4-6-12)14-10-20-17-16(14)15(18)7-8-19-17/h2-8,10,13H,9H2,1H3,(H,19,20)
InChIKey GLNZXBMOZIDWRI-UHFFFAOYSA-N
Molecular Weight 298.773 g/mol
SMILES [nH]1cc(c2c1nccc2Cl)C(CC(C)=O)c1ccccc1
SPLASH splash10-0007-0090000000-d622053388d6127a84b5
Source of Spectrum K1-0-2399-3
Wiley ID 1588917