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3-(ORTHO-BROMOPHENYL)-2,4-DIAZABICYCLO-[4.2.0]-OCTA-1(6),2-DIEN-5-ONE
SpectraBase Compound ID 7ebWfa8Cbz
InChI InChI=1S/C12H9BrN2O/c13-9-4-2-1-3-7(9)11-14-10-6-5-8(10)12(16)15-11/h1-4H,5-6H2,(H,14,15,16)
InChIKey HGQZOBWCBNFOOM-UHFFFAOYSA-N
Mol Weight 277.12 g/mol
Molecular Formula C12H9BrN2O
Exact Mass 275.989826 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DtXgQTctG1X
Name 4-(2-bromophenyl)-3,5-diazabicyclo[4.2.0]octa-1(6),3-dien-2-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H9BrN2O
InChI InChI=1S/C12H9BrN2O/c13-9-4-2-1-3-7(9)11-14-10-6-5-8(10)12(16)15-11/h1-4H,5-6H2,(H,14,15,16)
InChIKey HGQZOBWCBNFOOM-UHFFFAOYSA-N
Molecular Weight 277.121 g/mol
SMILES N1C(C2=C(N=C1c1c(cccc1)Br)CC2)=O
SPLASH splash10-004i-2590000000-d3b85470073093d64369
Source of Spectrum K1-0-2758-6
Wiley ID 1588983