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3-(2-Aminopyrimidin-4-yl)-4-chlorocoumarin
SpectraBase Compound ID 1zroMMV0ExO
InChI InChI=1S/C13H8ClN3O2/c14-11-7-3-1-2-4-9(7)19-12(18)10(11)8-5-6-16-13(15)17-8/h1-6H,(H2,15,16,17)
InChIKey YOYSZYRBPPFARI-UHFFFAOYSA-N
Mol Weight 273.68 g/mol
Molecular Formula C13H8ClN3O2
Exact Mass 273.030504 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8OwGoZawUR3
Name 3-(2-Aminopyrimidin-4-yl)-4-chlorocoumarin
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8ClN3O2
InChI InChI=1S/C13H8ClN3O2/c14-11-7-3-1-2-4-9(7)19-12(18)10(11)8-5-6-16-13(15)17-8/h1-6H,(H2,15,16,17)
InChIKey YOYSZYRBPPFARI-UHFFFAOYSA-N
Instrument Name Shimadzu GC-2010
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3811
Molecular Weight 273.679 g/mol
SMILES Nc1nccc(n1)C=1C(Oc2c(C1Cl)cccc2)=O
SPLASH splash10-03k9-9420000000-5de153206a5471eaf5ee
Source of Spectrum Y-57-719-2
Wiley ID 1860029