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6-Benzyl-2-methoxy-3-methyl-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione
SpectraBase Compound ID DG9ZuWvuGaS
InChI InChI=1S/C16H18N4O3/c1-19-15(22)12-10-20(9-11-6-4-3-5-7-11)13(21)8-17-14(12)18-16(19)23-2/h3-7,17H,8-10H2,1-2H3
InChIKey OTKNDTXCUKYGHO-UHFFFAOYSA-N
Mol Weight 314.35 g/mol
Molecular Formula C16H18N4O3
Exact Mass 314.13789 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 22IAYQt13m3
Name 6-Benzyl-2-methoxy-3-methyl-5,6,8,9-tetrahydro-3H-pyrimido[4,5-e][1,4]diazepine-4,7-dione
Appearance Colourless solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H18N4O3
InChI InChI=1S/C16H18N4O3/c1-19-15(22)12-10-20(9-11-6-4-3-5-7-11)13(21)8-17-14(12)18-16(19)23-2/h3-7,17H,8-10H2,1-2H3
InChIKey OTKNDTXCUKYGHO-UHFFFAOYSA-N
Instrument Name SHIMADZU 2010-DI-2010
Ionization Type EI
Literature Reference DOI 10.1016/j.arabjc.2016.07.012
Molecular Weight 314.345 g/mol
Reported Formula C16H18N4O3
SMILES N1CC(N(CC=2C(N(C(=NC12)OC)C)=O)Cc1ccccc1)=O
SPLASH splash10-00e9-4941000000-a7f4a21068722e4e3ac1
Source of Spectrum AJC-12-SM116-8d
Wiley ID 1857398