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7-Methyl-1-(4-methylphenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
SpectraBase Compound ID Dknmzkq4niq
InChI InChI=1S/C21H16N2O5/c1-12-3-6-15(7-4-12)27-18-10-14(23(25)26)11-19-20(18)21(24)22-16-8-5-13(2)9-17(16)28-19/h3-11H,1-2H3,(H,22,24)
InChIKey PGHQEOQDONAMFA-UHFFFAOYSA-N
Mol Weight 376.37 g/mol
Molecular Formula C21H16N2O5
Exact Mass 376.105922 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Z2cO2d4aAA
Name 7-Methyl-1-(4-methylphenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Alternate Name(s) 2-Methyl-7-(4-methylphenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H16N2O5
InChI InChI=1S/C21H16N2O5/c1-12-3-6-15(7-4-12)27-18-10-14(23(25)26)11-19-20(18)21(24)22-16-8-5-13(2)9-17(16)28-19/h3-11H,1-2H3,(H,22,24)
InChIKey PGHQEOQDONAMFA-UHFFFAOYSA-N
Molecular Weight 376.368 g/mol
SMILES N1c2c(Oc3c(C1=O)c(cc(c3)N(=O)=O)Oc1ccc(cc1)C)cc(cc2)C
SPLASH splash10-00or-7944000000-8683e2d87a34d84957e1
Wiley ID 1442250