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5-Bromo-4-chloro-7-methoxycarbonylpyrido[3',2':4,5]pyrrolo[1,2-c]pyrimidine
SpectraBase Compound ID 4llN1KFtS5U
InChI InChI=1S/C12H7BrClN3O2/c1-19-12(18)7-4-8-10(13)9-6(14)2-3-15-11(9)17(8)5-16-7/h2-5H,1H3
InChIKey PKDLDKGAWQKSLC-UHFFFAOYSA-N
Mol Weight 340.56 g/mol
Molecular Formula C12H7BrClN3O2
Exact Mass 338.941017 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KRURXh66y0L
Name 5-Bromo-4-chloro-7-methoxycarbonylpyrido[3',2':4,5]pyrrolo[1,2-c]pyrimidine
Alternate Name(s) methyl 5-bromo-4-chloropyrido[3',2':4,5]pyrrolo[1,2-c]pyrimidine-7-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C12H7BrClN3O2
InChI InChI=1S/C12H7BrClN3O2/c1-19-12(18)7-4-8-10(13)9-6(14)2-3-15-11(9)17(8)5-16-7/h2-5H,1H3
InChIKey PKDLDKGAWQKSLC-UHFFFAOYSA-N
Molecular Weight 340.564 g/mol
SMILES C=1[n]2c(C=C(N1)C(=O)OC)c(c1c2nccc1Cl)Br
SPLASH splash10-0006-0009000000-eaf588e8371536c7f5ac
Source of Spectrum F-69-4981-29
Wiley ID 1595289