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2-Amino-4-(4-chlorophenyl)-3,4-dihydro-(5H)-[1]benzopyrano[4,3-c]pyrimidine
SpectraBase Compound ID Gb52GR8GXrD
InChI InChI=1S/C17H14ClN3O/c18-11-7-5-10(6-8-11)15-13-9-22-14-4-2-1-3-12(14)16(13)21-17(19)20-15/h1-8,15H,9H2,(H3,19,20,21)
InChIKey MBRMBFDZYYZYRN-UHFFFAOYSA-N
Mol Weight 311.77 g/mol
Molecular Formula C17H14ClN3O
Exact Mass 311.08254 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EHHxooMedg7
Name 2-Amino-4-(4-chlorophenyl)-3,4-dihydro-(5H)-[1]benzopyrano[4,3-c]pyrimidine
Alternate Name(s) 4-(4-Chlorophenyl)-4,5-dihydro-1H-[1]benzopyrano[4,3-d]pyrimidin-2-amine 4-(4-Chlorophenyl)-4,5-dihydro-1H-chromeno[4,3-d]pyrimidin-2-amine
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Formula C17H14ClN3O
InChI InChI=1S/C17H14ClN3O/c18-11-7-5-10(6-8-11)15-13-9-22-14-4-2-1-3-12(14)16(13)21-17(19)20-15/h1-8,15H,9H2,(H3,19,20,21)
InChIKey MBRMBFDZYYZYRN-UHFFFAOYSA-N
Molecular Weight 311.772 g/mol
SMILES N1C(C2=C(N=C1N)c1c(OC2)cccc1)c1ccc(cc1)Cl
SPLASH splash10-01oy-0092000000-1b22e8cb27fa79d4f5ae
Source of Spectrum Y1-42-1987-9
Wiley ID 1565321