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4-(4-Methoxyphenyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)butan-2-one
SpectraBase Compound ID 7xyNva82Ueu
InChI InChI=1S/C18H18N2O2/c1-12(21)10-16(13-5-7-14(22-2)8-6-13)17-11-20-18-15(17)4-3-9-19-18/h3-9,11,16H,10H2,1-2H3,(H,19,20)
InChIKey QRTHOTIIWUIQGA-UHFFFAOYSA-N
Mol Weight 294.35 g/mol
Molecular Formula C18H18N2O2
Exact Mass 294.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EVfuKYKyieq
Name 4-(4-Methoxyphenyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)butan-2-one
Comments Less than 3 mono-isotopic peaks
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Formula C18H18N2O2
InChI InChI=1S/C18H18N2O2/c1-12(21)10-16(13-5-7-14(22-2)8-6-13)17-11-20-18-15(17)4-3-9-19-18/h3-9,11,16H,10H2,1-2H3,(H,19,20)
InChIKey QRTHOTIIWUIQGA-UHFFFAOYSA-N
Molecular Weight 294.354 g/mol
SMILES [nH]1cc(c2c1nccc2)C(CC(C)=O)c1ccc(cc1)OC
SPLASH splash10-000l-0090000000-1bf0eb3e26b37372d164
Source of Spectrum K1-0-2399-3
Synonyms 4-(4-methoxyphenyl)-4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-2-butanone
Wiley ID 1588913