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2-(4-Bromo-benzyl)-1-oxa-3,3a,10-triaza-pentaleno[1,2-b]naphthalene-4,9-dione
SpectraBase Compound ID 1qMi20El4Kr
InChI InChI=1S/C19H10BrN3O3/c20-11-7-5-10(6-8-11)9-14-22-23-16-15(21-19(23)26-14)17(24)12-3-1-2-4-13(12)18(16)25/h1-8H,9H2
InChIKey DXAYWELRMPXWRV-UHFFFAOYSA-N
Mol Weight 408.21 g/mol
Molecular Formula C19H10BrN3O3
Exact Mass 406.990554 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KqAJg33F141
Name 2-(4-Bromo-benzyl)-1-oxa-3,3a,10-triaza-pentaleno[1,2-b]naphthalene-4,9-dione
Appearance Reddish brown crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H10BrN3O3
InChI InChI=1S/C19H10BrN3O3/c20-11-7-5-10(6-8-11)9-14-22-23-16-15(21-19(23)26-14)17(24)12-3-1-2-4-13(12)18(16)25/h1-8H,9H2
InChIKey DXAYWELRMPXWRV-UHFFFAOYSA-N
Instrument Name AMD 604
Ionization Type EI
Literature Reference DOI 10.3998/ark.5550190.0008.124
Molecular Weight 408.211 g/mol
SMILES c12C(c3c(C(c2nc2[n]1N=C(O2)Cc1ccc(cc1)Br)=O)cccc3)=O
SPLASH splash10-00mn-9703000000-54ede5fc8c093ef1e8c9
Source of Spectrum ARK-2007-232-11d
Wiley ID 1871350