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Dimethyl 2-methyl-2-(4'-chloro-2'-nitrophenoxy)malonate
SpectraBase Compound ID KfhRDwG6Fdj
InChI InChI=1S/C12H12ClNO7/c1-12(10(15)19-2,11(16)20-3)21-9-5-4-7(13)6-8(9)14(17)18/h4-6H,1-3H3
InChIKey KHHXUUPEJCAPNZ-UHFFFAOYSA-N
Mol Weight 317.68 g/mol
Molecular Formula C12H12ClNO7
Exact Mass 317.030229 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LDyFZCJy6nQ
Name Dimethyl 2-methyl-2-(4'-chloro-2'-nitrophenoxy)malonate
Alternate Name(s) dimethyl 2-(4-chloro-2-nitrophenoxy)-2-methylmalonate
Comments Less than 3 mono-isotopic peaks
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Formula C12H12ClNO7
InChI InChI=1S/C12H12ClNO7/c1-12(10(15)19-2,11(16)20-3)21-9-5-4-7(13)6-8(9)14(17)18/h4-6H,1-3H3
InChIKey KHHXUUPEJCAPNZ-UHFFFAOYSA-N
Molecular Weight 317.681 g/mol
SMILES C(Oc1c(N(=O)=O)cc(cc1)Cl)(C(=O)OC)(C(=O)OC)C
SPLASH splash10-03di-0900000000-cf7a2c7ddc99e9d49825
Source of Spectrum QC-8-429-2
Wiley ID 869749