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9-Bromo-2-methyl-5-oxo-4-propyl-5H-chromeno[3,4-c]pyridine-1-carbonitrile
SpectraBase Compound ID 5yo5lXERXdw
InChI InChI=1S/C17H13BrN2O2/c1-3-4-13-16-15(12(8-19)9(2)20-13)11-7-10(18)5-6-14(11)22-17(16)21/h5-7H,3-4H2,1-2H3
InChIKey NCTKYDGUWQRDCD-UHFFFAOYSA-N
Mol Weight 357.21 g/mol
Molecular Formula C17H13BrN2O2
Exact Mass 356.016041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BYG8vSidRnt
Name 9-Bromo-2-methyl-5-oxo-4-propyl-5H-chromeno[3,4-c]pyridine-1-carbonitrile
Appearance Brownish powder
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Formula C17H13BrN2O2
InChI InChI=1S/C17H13BrN2O2/c1-3-4-13-16-15(12(8-19)9(2)20-13)11-7-10(18)5-6-14(11)22-17(16)21/h5-7H,3-4H2,1-2H3
InChIKey NCTKYDGUWQRDCD-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3826
Molecular Weight 357.207 g/mol
SMILES c1(Br)cc-2c(cc1)OC(c1c(nc(c(c21)C#N)C)CCC)=O
SPLASH splash10-004i-0009000000-38e2ea72956edc548c65
Source of Spectrum Y-57-819-5j
Wiley ID 1860041