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1-[(3'-Nitrophenyl)methylene]-(4'-aza)-yclopentaquinazolin-4-one
SpectraBase Compound ID 2izNtxSmlDT
InChI InChI=1S/C18H13N3O3/c22-18-15-6-1-2-7-16(15)19-17-13(8-9-20(17)18)10-12-4-3-5-14(11-12)21(23)24/h1-7,10-11H,8-9H2/b13-10-
InChIKey XIQBVHOTWVNRBA-RAXLEYEMSA-N
Mol Weight 319.32 g/mol
Molecular Formula C18H13N3O3
Exact Mass 319.095691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5VP3Jvh9QcG
Name 1-[(3'-Nitrophenyl)methylene]-(4'-aza)-yclopentaquinazolin-4-one
Comments Less than 3 mono-isotopic peaks
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Formula C18H13N3O3
InChI InChI=1S/C18H13N3O3/c22-18-15-6-1-2-7-16(15)19-17-13(8-9-20(17)18)10-12-4-3-5-14(11-12)21(23)24/h1-7,10-11H,8-9H2/b13-10-
InChIKey XIQBVHOTWVNRBA-RAXLEYEMSA-N
Molecular Weight 319.320 g/mol
SMILES C1=2N(C(c3c(N2)cccc3)=O)CC\C1=C/c1cc(N(=O)=O)ccc1
SPLASH splash10-014i-0029000000-d0a677ff13942a2f1ccf
Source of Spectrum X4-13-463-0
Synonyms (3Z)-3-[(3-nitrophenyl)methylene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one (3Z)-3-[(3-nitrophenyl)methylidene]-1,2-dihydropyrrolo[2,1-b]quinazolin-9-one
Wiley ID 1585165