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Ethyl [2-(nitromethylene)hexahydropyrimidin-1-yl]acetate
SpectraBase Compound ID G5dB0qR09qM
InChI InChI=1S/C9H15N3O4/c1-2-16-9(13)7-11-5-3-4-10-8(11)6-12(14)15/h6,10H,2-5,7H2,1H3/b8-6+
InChIKey GHJTYRHZRDQHRB-SOFGYWHQSA-N
Mol Weight 229.24 g/mol
Molecular Formula C9H15N3O4
Exact Mass 229.106256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BJ6KLQ2WX2W
Name Ethyl [2-(nitromethylene)hexahydropyrimidin-1-yl]acetate
Alternate Name(s) Ethyl ((2E)-2-(nitromethylene)tetrahydro-1(2H)-pyrimidinyl)acetate 2-[(2E)-2-(nitromethylidene)-1,3-diazinan-1-yl]acetic acid ethyl ester Ethyl 2-[(2E)-2-(nitromethylidene)-1,3-diazinan-1-yl]acetate Ethyl 2-[(2E)-2-(nitromethylene)hexahydropyrimidin-1-yl]acetate Ethyl 2-[(2E)-2-(nitromethylidene)-1,3-diazinan-1-yl]ethanoate
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Formula C9H15N3O4
InChI InChI=1S/C9H15N3O4/c1-2-16-9(13)7-11-5-3-4-10-8(11)6-12(14)15/h6,10H,2-5,7H2,1H3/b8-6+
InChIKey GHJTYRHZRDQHRB-SOFGYWHQSA-N
Molecular Weight 229.236 g/mol
SMILES N1CCCN(\C1=C/N(=O)=O)CC(=O)OCC
SPLASH splash10-074i-5900000000-ecbc85975ab715592b5f
Source of Spectrum SO-0-1442-4
Wiley ID 1545431