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6-(4-Bromophenyl)-8,9-dihydro-3-methyl-2-morpholino-3H-pyrimido[4,5-b][1,4]diazepin-4(7H)-one
SpectraBase Compound ID 3QGBYReOBFE
InChI InChI=1S/C18H20BrN5O2/c1-23-17(25)15-16(22-18(23)24-8-10-26-11-9-24)20-7-6-14(21-15)12-2-4-13(19)5-3-12/h2-5,20H,6-11H2,1H3
InChIKey LWCZOUQSYRVZJR-UHFFFAOYSA-N
Mol Weight 418.3 g/mol
Molecular Formula C18H20BrN5O2
Exact Mass 417.080038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BUNOOuQqCi4
Name 6-(4-Bromophenyl)-8,9-dihydro-3-methyl-2-morpholino-3H-pyrimido[4,5-b][1,4]diazepin-4(7H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H20BrN5O2
InChI InChI=1S/C18H20BrN5O2/c1-23-17(25)15-16(22-18(23)24-8-10-26-11-9-24)20-7-6-14(21-15)12-2-4-13(19)5-3-12/h2-5,20H,6-11H2,1H3
InChIKey LWCZOUQSYRVZJR-UHFFFAOYSA-N
Molecular Weight 418.295 g/mol
SMILES N1CCC(=NC2=C1N=C(N(C2=O)C)N1CCOCC1)c1ccc(cc1)Br
SPLASH splash10-00m0-3934600000-1e20ebef5cbe27e63670
Source of Spectrum Y-51-200-5o
Synonyms 6-(4-Bromophenyl)-8,9-dihydro-3-methyl-2-morpholino-3Hpyrimido[4,5-b][1,4]diazepin-4(7H)-one 6-(4-bromophenyl)-3-methyl-2-morpholino-8,9-dihydro-3H-pyrimido[4,5-b][1,4]diazepin-4(7H)-one
Wiley ID 1741823