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2-[(4-methoxybenzoyl)(2,4-dinitrophenyl)methylene]hexahydropyrimidine
SpectraBase Compound ID FlgHqjdYLkS
InChI InChI=1S/C19H18N4O6/c1-29-14-6-3-12(4-7-14)18(24)17(19-20-9-2-10-21-19)15-8-5-13(22(25)26)11-16(15)23(27)28/h3-8,11,20-21H,2,9-10H2,1H3
InChIKey SXZHMYICFYRVJR-UHFFFAOYSA-N
Mol Weight 398.38 g/mol
Molecular Formula C19H18N4O6
Exact Mass 398.122634 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4cokMBYDWJV
Name 2-[(4-methoxybenzoyl)(2,4-dinitrophenyl)methylene]hexahydropyrimidine
Alternate Name(s) 2-(2,4-dinitrophenyl)-1-(4-methoxyphenyl)-2-tetrahydro-2(1H)-pyrimidinylideneethanone
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18N4O6
InChI InChI=1S/C19H18N4O6/c1-29-14-6-3-12(4-7-14)18(24)17(19-20-9-2-10-21-19)15-8-5-13(22(25)26)11-16(15)23(27)28/h3-8,11,20-21H,2,9-10H2,1H3
InChIKey SXZHMYICFYRVJR-UHFFFAOYSA-N
Molecular Weight 398.375 g/mol
SMILES N1CCCNC1=C(c1c(N(=O)=O)cc(N(=O)=O)cc1)C(c1ccc(cc1)OC)=O
SPLASH splash10-000i-0901000000-0d2d37656cdaa5225e7f
Source of Spectrum KC-0-1969-5
Wiley ID 820718