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1-[2',4',6'-Trichloropyrimidin-5'-yl]propan-1-one
SpectraBase Compound ID 2RJsfDxQyED
InChI InChI=1S/C7H5Cl3N2O/c1-2-3(13)4-5(8)11-7(10)12-6(4)9/h2H2,1H3
InChIKey FGLKSEPJNGLVFR-UHFFFAOYSA-N
Mol Weight 239.49 g/mol
Molecular Formula C7H5Cl3N2O
Exact Mass 237.946746 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EsCnQJs0ZLH
Name 1-[2',4',6'-Trichloropyrimidin-5'-yl]propan-1-one
Alternate Name(s) 1-(2,4,6-Trichloropyrimidin-5-yl)propan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H5Cl3N2O
InChI InChI=1S/C7H5Cl3N2O/c1-2-3(13)4-5(8)11-7(10)12-6(4)9/h2H2,1H3
InChIKey FGLKSEPJNGLVFR-UHFFFAOYSA-N
Literature Reference DOI 10.1021/jo100884u
Molecular Weight 239.489 g/mol
SMILES c1(c(C(CC)=O)c(nc(Cl)n1)Cl)Cl
SPLASH splash10-08fr-0090000000-1d6576d1dea9c7ba4e32
Source of Spectrum J-75-4691-7c
Wiley ID 1746623