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8-Chloro-1-(4-methylphenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
SpectraBase Compound ID 4wMUyUYGiCH
InChI InChI=1S/C20H13ClN2O5/c1-11-2-5-14(6-3-11)27-17-9-13(23(25)26)10-18-19(17)20(24)22-15-8-12(21)4-7-16(15)28-18/h2-10H,1H3,(H,22,24)
InChIKey PBVCWJWIDVUHDZ-UHFFFAOYSA-N
Mol Weight 396.79 g/mol
Molecular Formula C20H13ClN2O5
Exact Mass 396.051299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CRWHkrh1kdl
Name 8-Chloro-1-(4-methylphenoxy)-3-nitrodibenzo[b,f][1,4]oxazepin-11(10H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H13ClN2O5
InChI InChI=1S/C20H13ClN2O5/c1-11-2-5-14(6-3-11)27-17-9-13(23(25)26)10-18-19(17)20(24)22-15-8-12(21)4-7-16(15)28-18/h2-10H,1H3,(H,22,24)
InChIKey PBVCWJWIDVUHDZ-UHFFFAOYSA-N
Molecular Weight 396.786 g/mol
SMILES N1c2c(Oc3c(C1=O)c(cc(c3)N(=O)=O)Oc1ccc(cc1)C)ccc(c2)Cl
SPLASH splash10-0006-9411000000-095eecf72b301c82bfad
Synonyms 3-Chloranyl-7-(4-methylphenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one 3-Chloro-7-(4-methylphenoxy)-9-nitro-5H-benzo[b][1,4]benzoxazepin-6-one
Wiley ID 1442100