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9-Chloranyl-3,4-dihydro-1H-[1]benzofuro[3,2-b]azepine-2,5-dione
SpectraBase Compound ID BH71hJs04BD
InChI InChI=1S/C12H8ClNO3/c13-6-1-3-9-7(5-6)11-12(17-9)8(15)2-4-10(16)14-11/h1,3,5H,2,4H2,(H,14,16)
InChIKey UMKIBXQNCYVTSS-UHFFFAOYSA-N
Mol Weight 249.65 g/mol
Molecular Formula C12H8ClNO3
Exact Mass 249.019271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AvX4emwel82
Name 9-Chloranyl-3,4-dihydro-1H-[1]benzofuro[3,2-b]azepine-2,5-dione
Alternate Name(s) 9-Chloro-3,4-dihydro-1H-benzofuro[3,2-b]azepine-2,5-dione 9-Chloro-3,4-dihydro-1H-benzofur[3,2-b]azepine-2,5-quinone 9-Chloro-3,4-dihydro-1H-[1]benzofuro[3,2-b]azepine-2,5-dione
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Formula C12H8ClNO3
InChI InChI=1S/C12H8ClNO3/c13-6-1-3-9-7(5-6)11-12(17-9)8(15)2-4-10(16)14-11/h1,3,5H,2,4H2,(H,14,16)
InChIKey UMKIBXQNCYVTSS-UHFFFAOYSA-N
Molecular Weight 249.653 g/mol
SMILES N1c2c(C(CCC1=O)=O)oc1ccc(cc21)Cl
SPLASH splash10-00dm-6950000000-aad9f3da6dc410e5d6d6
Wiley ID 1511574