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4-(6-Chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butan-2-one
SpectraBase Compound ID Gbobqiw7JxQ
InChI InChI=1S/C11H11ClN2O/c1-7(15)2-3-8-6-13-11-9(8)4-5-10(12)14-11/h4-6H,2-3H2,1H3,(H,13,14)
InChIKey AYSOLCNSCOLVPJ-UHFFFAOYSA-N
Mol Weight 222.67 g/mol
Molecular Formula C11H11ClN2O
Exact Mass 222.055991 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LEf3wRqthzQ
Name 4-(6-Chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)butan-2-one
Alternate Name(s) 4-(6-chloranyl-1H-pyrrolo[2,3-b]pyridin-3-yl)butan-2-one 4-(6-chloro-1H-pyrrolo[2,3-b]pyridin-3-yl)-2-butanone
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11ClN2O
InChI InChI=1S/C11H11ClN2O/c1-7(15)2-3-8-6-13-11-9(8)4-5-10(12)14-11/h4-6H,2-3H2,1H3,(H,13,14)
InChIKey AYSOLCNSCOLVPJ-UHFFFAOYSA-N
Molecular Weight 222.675 g/mol
SMILES [nH]1cc(c2c1nc(cc2)Cl)CCC(C)=O
SPLASH splash10-00b9-0590000000-99b0763f1696dc437232
Source of Spectrum K1-0-2399-3
Wiley ID 1588920