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(5E,9E)-16-(4-Nitroanilino)-7,8-dihydro-16lambda5-dibenzo[d,l]-[1,3,7,10,2]dioxadiazaphosphacyclotridecin-16-one
SpectraBase Compound ID G52L64xs84m
InChI InChI=1S/C22H19N4O5P/c27-26(28)20-11-9-19(10-12-20)25-32(29)30-21-7-3-1-5-17(21)15-23-13-14-24-16-18-6-2-4-8-22(18)31-32/h1-12,15-16H,13-14H2,(H,25,29)/b23-15+,24-16+
InChIKey GRLCASQZNZPUPX-DFEHQXHXSA-N
Mol Weight 450.39 g/mol
Molecular Formula C22H19N4O5P
Exact Mass 450.109307 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7gb28OCKgsY
Name (5E,9E)-16-(4-Nitroanilino)-7,8-dihydro-16lambda5-dibenzo[d,l]-[1,3,7,10,2]dioxadiazaphosphacyclotridecin-16-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H19N4O5P
InChI InChI=1S/C22H19N4O5P/c27-26(28)20-11-9-19(10-12-20)25-32(29)30-21-7-3-1-5-17(21)15-23-13-14-24-16-18-6-2-4-8-22(18)31-32/h1-12,15-16H,13-14H2,(H,25,29)/b23-15+,24-16+
InChIKey GRLCASQZNZPUPX-DFEHQXHXSA-N
Literature Reference DOI 10.1002/ardp.201100204
Molecular Weight 450.391 g/mol
SMILES N(P1(Oc2c(cccc2)\C=N\CC\N=C\c2ccccc2O1)=O)c1ccc(cc1)[N+](=O)[O-]
SPLASH splash10-0udj-0239200000-3ec014d2df5e6f2ea978
Source of Spectrum APC-345-501-6k
Synonyms (5E,9E)-16-((4-nitrophenyl)amino)-7,8-dihydrodibenzo[d,l][1,3,7,10,2]dioxadiazaphosphacyclotridecine 16-oxide
Wiley ID 1769395