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Dimethyl [N-(chloroacetyl)-p-nitroanilino]-malonate
SpectraBase Compound ID IkFSmBXZfv
InChI InChI=1S/C13H13ClN2O7/c1-22-12(18)11(13(19)23-2)15(10(17)7-14)8-3-5-9(6-4-8)16(20)21/h3-6,11H,7H2,1-2H3
InChIKey CMHCMNCIMBNOEJ-UHFFFAOYSA-N
Mol Weight 344.71 g/mol
Molecular Formula C13H13ClN2O7
Exact Mass 344.041128 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JP1YYZv3yHN
Name Dimethyl [N-(chloroacetyl)-p-nitroanilino]-malonate
Alternate Name(s) Dimethyl 2-[(chloroacetyl)-4-nitroanilino]malonate
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Formula C13H13ClN2O7
InChI InChI=1S/C13H13ClN2O7/c1-22-12(18)11(13(19)23-2)15(10(17)7-14)8-3-5-9(6-4-8)16(20)21/h3-6,11H,7H2,1-2H3
InChIKey CMHCMNCIMBNOEJ-UHFFFAOYSA-N
Molecular Weight 344.707 g/mol
SMILES C(C(C(=O)OC)N(c1ccc(cc1)N(=O)=O)C(=O)CCl)(=O)OC
SPLASH splash10-0aor-1292000000-b78e6779214dff27822e
Source of Spectrum F2-120-195-3
Wiley ID 1549640