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2-((2-Chloroquinolin-3-yl)(hydroxy)methyl)acrylonitrile
SpectraBase Compound ID 6X8L7Akel8B
InChI InChI=1S/C13H9ClN2O/c1-8(7-15)12(17)10-6-9-4-2-3-5-11(9)16-13(10)14/h2-6,12,17H,1H2
InChIKey CXSQRPZDNCNBOC-UHFFFAOYSA-N
Mol Weight 244.68 g/mol
Molecular Formula C13H9ClN2O
Exact Mass 244.040341 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID gLuuT3SRJ3
Name 2-((2-Chloroquinolin-3-yl)(hydroxy)methyl)acrylonitrile
Alternate Name(s) 2-[(2-chloro-3-quinolinyl)-hydroxymethyl]-2-propenenitrile 2-[(2-chloroquinolin-3-yl)-hydroxymethyl]prop-2-enenitrile 2-[(2-chloro-3-quinolyl)-hydroxy-methyl]prop-2-enenitrile 2-[(2-chloranylquinolin-3-yl)-oxidanyl-methyl]prop-2-enenitrile
Comments Less than 3 mono-isotopic peaks
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Formula C13H9ClN2O
InChI InChI=1S/C13H9ClN2O/c1-8(7-15)12(17)10-6-9-4-2-3-5-11(9)16-13(10)14/h2-6,12,17H,1H2
InChIKey CXSQRPZDNCNBOC-UHFFFAOYSA-N
Molecular Weight 244.681 g/mol
SMILES OC(c1c(nc2c(c1)cccc2)Cl)C(C#N)=C
SPLASH splash10-0002-0090000000-94f646b705be723f23ad
Source of Spectrum Y-49-85-3d
Wiley ID 1706640