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2-(5-bromo-6-formyl-3-methyl-2,4-dioxo-pyrimidin-1-yl)ethyl nitrate
SpectraBase Compound ID ENCDn9su8ov
InChI InChI=1S/C8H8BrN3O6/c1-10-7(14)6(9)5(4-13)11(8(10)15)2-3-18-12(16)17/h4H,2-3H2,1H3
InChIKey PAQINCGATKGYNM-UHFFFAOYSA-N
Mol Weight 322.07 g/mol
Molecular Formula C8H8BrN3O6
Exact Mass 320.959648 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Dceqt1LuIpS
Name 2-(5-bromo-6-formyl-3-methyl-2,4-dioxo-pyrimidin-1-yl)ethyl nitrate
Alternate Name(s) 2-[5-bromanyl-6-methanoyl-3-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethyl nitrate nitric acid 2-(5-bromo-6-formyl-2,4-diketo-3-methyl-pyrimidin-1-yl)ethyl ester nitric acid 2-(5-bromo-6-formyl-3-methyl-2,4-dioxo-1-pyrimidinyl)ethyl ester
Comments Less than 3 mono-isotopic peaks
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Formula C8H8BrN3O6
InChI InChI=1S/C8H8BrN3O6/c1-10-7(14)6(9)5(4-13)11(8(10)15)2-3-18-12(16)17/h4H,2-3H2,1H3
InChIKey PAQINCGATKGYNM-UHFFFAOYSA-N
Molecular Weight 322.071 g/mol
SMILES C(ON(=O)=O)CN1C(N(C(C(=C1C=O)Br)=O)C)=O
SPLASH splash10-00di-0009000000-e9e566d2e5ef10965adc
Source of Spectrum E1-41-2076-8
Wiley ID 1552273