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1-((2-Bromobenzylidene)amino)-2,5-dioxo-1,5-dihydro-2H-chromeno[4,3-b]pyridine-3-carbonitrile
SpectraBase Compound ID LbcD4vbD4EJ
InChI InChI=1S/C20H10BrN3O3/c21-16-7-3-1-5-12(16)11-23-24-18-14-6-2-4-8-17(14)27-20(26)15(18)9-13(10-22)19(24)25/h1-9,11H
InChIKey LZJJZXHCXNKIGF-UHFFFAOYSA-N
Mol Weight 420.22 g/mol
Molecular Formula C20H10BrN3O3
Exact Mass 418.990554 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Z2vQnrwc7X
Name 1-((2-Bromobenzylidene)amino)-2,5-dioxo-1,5-dihydro-2H-chromeno[4,3-b]pyridine-3-carbonitrile
Appearance Pale-yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H10BrN3O3
InChI InChI=1S/C20H10BrN3O3/c21-16-7-3-1-5-12(16)11-23-24-18-14-6-2-4-8-17(14)27-20(26)15(18)9-13(10-22)19(24)25/h1-9,11H
InChIKey LZJJZXHCXNKIGF-UHFFFAOYSA-N
Instrument Name Shimadzu GCMS QP1000EX
Ionization Type EI
Literature Reference DOI 10.1002/cbdv.202300706
Molecular Weight 420.222 g/mol
SMILES C1(Br)=C(C=CC=C1)C=NN1C2=C(C=C(C1=O)C#N)C(OC1=C2C=CC=C1)=O
SPLASH splash10-0k9x-4229100000-ce4426f90b3f69fbfc98
Source of Spectrum CBD-20-SM26-8 (DOI: 10.1002/cbdv.202300706)
Wiley ID 1911330