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1-(2,4-Dinitrophenyl)-2,2-diethoxycarbonylethanol
SpectraBase Compound ID DHkr2x6uleW
InChI InChI=1S/C14H16N2O9/c1-3-24-13(18)11(14(19)25-4-2)12(17)9-6-5-8(15(20)21)7-10(9)16(22)23/h5-7,11-12,17H,3-4H2,1-2H3
InChIKey HJMNEZXALNREBE-UHFFFAOYSA-N
Mol Weight 356.29 g/mol
Molecular Formula C14H16N2O9
Exact Mass 356.08558 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B30K2M9ZQUS
Name 1-(2,4-Dinitrophenyl)-2,2-diethoxycarbonylethanol
Alternate Name(s) Diethyl 2-[(2,4-dinitrophenyl)(hydroxy)methyl]malonate
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Formula C14H16N2O9
InChI InChI=1S/C14H16N2O9/c1-3-24-13(18)11(14(19)25-4-2)12(17)9-6-5-8(15(20)21)7-10(9)16(22)23/h5-7,11-12,17H,3-4H2,1-2H3
InChIKey HJMNEZXALNREBE-UHFFFAOYSA-N
Molecular Weight 356.287 g/mol
SMILES OC(C(C(=O)OCC)C(=O)OCC)c1c(cc(cc1)N(=O)=O)N(=O)=O
SPLASH splash10-01c0-0900000000-1b7296165bb9cec2041b
Source of Spectrum SO-0-657-4
Wiley ID 1537984