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4-{[(3',4'-Dihydro-4'-methyl-7'-nitro-3'-oxo-2H-1',4'-benzoxazin-2'-yl)amino]methyl}-benzonitrile
SpectraBase Compound ID K2an1kwtvr4
InChI InChI=1S/C17H14N4O4/c1-20-14-7-6-13(21(23)24)8-15(14)25-16(17(20)22)19-10-12-4-2-11(9-18)3-5-12/h2-8,16,19H,10H2,1H3
InChIKey SCJVLGDISQCICE-UHFFFAOYSA-N
Mol Weight 338.32 g/mol
Molecular Formula C17H14N4O4
Exact Mass 338.101505 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JAS06wnL4u6
Name 4-{[(3',4'-Dihydro-4'-methyl-7'-nitro-3'-oxo-2H-1',4'-benzoxazin-2'-yl)amino]methyl}-benzonitrile
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Formula C17H14N4O4
InChI InChI=1S/C17H14N4O4/c1-20-14-7-6-13(21(23)24)8-15(14)25-16(17(20)22)19-10-12-4-2-11(9-18)3-5-12/h2-8,16,19H,10H2,1H3
InChIKey SCJVLGDISQCICE-UHFFFAOYSA-N
Molecular Weight 338.323 g/mol
SMILES N(C1C(N(c2c(O1)cc(N(=O)=O)cc2)C)=O)Cc1ccc(C#N)cc1
SPLASH splash10-0159-0900000000-1e63f8df3fefabec48a1
Source of Spectrum H-91-661-8a
Wiley ID 1693325