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1-Nitro-3-(phenylsulfanyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
SpectraBase Compound ID 7S6rjUURRuB
InChI InChI=1S/C19H12N2O4S/c22-19-18-15(21(23)24)10-13(26-12-6-2-1-3-7-12)11-17(18)25-16-9-5-4-8-14(16)20-19/h1-11H,(H,20,22)
InChIKey GWICKSQYLPEDRR-UHFFFAOYSA-N
Mol Weight 364.38 g/mol
Molecular Formula C19H12N2O4S
Exact Mass 364.051778 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6XYg15buGC7
Name 1-Nitro-3-(phenylsulfanyl)dibenzo[b,f][1,4]oxazepin-11(10H)-one
Alternate Name(s) 7-nitro-9-(phenylthio)-5H-benzo[b][1,4]benzoxazepin-6-one 7-nitro-9-phenylsulfanyl-5H-benzo[b][1,4]benzoxazepin-6-one
Comments Less than 3 mono-isotopic peaks
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Formula C19H12N2O4S
InChI InChI=1S/C19H12N2O4S/c22-19-18-15(21(23)24)10-13(26-12-6-2-1-3-7-12)11-17(18)25-16-9-5-4-8-14(16)20-19/h1-11H,(H,20,22)
InChIKey GWICKSQYLPEDRR-UHFFFAOYSA-N
Molecular Weight 364.375 g/mol
SMILES N1C(c2c(Oc3c1cccc3)cc(cc2N(=O)=O)Sc1ccccc1)=O
SPLASH splash10-03xr-0009000000-62f5b733d19112f12803
Source of Spectrum F-70-9375-3
Wiley ID 1597756