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11-Amino-6-(4-bromophenyl)-6,7-dihydroindeno[1,2-e]pyrimido[4,5-b][1,4]diazepin-5(5aH)-one
SpectraBase Compound ID 1EiYUhTNozh
InChI InChI=1S/C20H14BrN5O/c21-11-7-5-10(6-8-11)15-14-16(12-3-1-2-4-13(12)18(14)27)26-20-17(25-15)19(22)23-9-24-20/h1-9,14-15,25H,(H2,22,23,24)
InChIKey QKVCAKCVTMAJGB-UHFFFAOYSA-N
Mol Weight 420.27 g/mol
Molecular Formula C20H14BrN5O
Exact Mass 419.038173 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7KqRLbbkhwL
Name 11-Amino-6-(4-bromophenyl)-6,7-dihydroindeno[1,2-e]pyrimido[4,5-b][1,4]diazepin-5(5aH)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H14BrN5O
InChI InChI=1S/C20H14BrN5O/c21-11-7-5-10(6-8-11)15-14-16(12-3-1-2-4-13(12)18(14)27)26-20-17(25-15)19(22)23-9-24-20/h1-9,14-15,25H,(H2,22,23,24)
InChIKey QKVCAKCVTMAJGB-UHFFFAOYSA-N
Molecular Weight 420.270 g/mol
SMILES N1C(C2C(=Nc3c1c(ncn3)N)c1ccccc1C2=O)c1ccc(cc1)Br
SPLASH splash10-00y0-0071900000-ae2e28998721d29fd5fe
Source of Spectrum Y-45-1661-4c
Synonyms 9-Amino-11-(4-bromo-phenyl)-11,11a-dihydro-10H-5,6,8,10-tetraaza-dibenzo[a,g]azulen-12-one
Wiley ID 1666534