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Dimethyl 2-[1-p-nitrophenyl-2-(tert-butylamino)-2-oxoetyl]malonata
SpectraBase Compound ID 9JxOces0ie4
InChI InChI=1S/C17H22N2O7/c1-17(2,3)18-14(20)12(13(15(21)25-4)16(22)26-5)10-6-8-11(9-7-10)19(23)24/h6-9,12-13H,1-5H3,(H,18,20)
InChIKey HNNQKJOIHGHZJV-UHFFFAOYSA-N
Mol Weight 366.37 g/mol
Molecular Formula C17H22N2O7
Exact Mass 366.142701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HcyQ1YivWsO
Name Dimethyl 2-[1-p-nitrophenyl-2-(tert-butylamino)-2-oxoetyl]malonata
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Formula C17H22N2O7
InChI InChI=1S/C17H22N2O7/c1-17(2,3)18-14(20)12(13(15(21)25-4)16(22)26-5)10-6-8-11(9-7-10)19(23)24/h6-9,12-13H,1-5H3,(H,18,20)
InChIKey HNNQKJOIHGHZJV-UHFFFAOYSA-N
Molecular Weight 366.370 g/mol
SMILES N(C(C(C(C(=O)OC)C(=O)OC)c1ccc(N(=O)=O)cc1)=O)C(C)(C)C
SPLASH splash10-066r-7961000000-7ab7202dc97dc50c0654
Source of Spectrum KC-57-1377-4
Synonyms 2-[2-(tert-butylamino)-1-(4-nitrophenyl)-2-oxoethyl]propanedioic acid dimethyl ester Dimethyl 2-[2-(tert-butylamino)-1-(4-nitrophenyl)-2-oxoethyl]propanedioate Dimethyl 2-[2-(tert-butylamino)-1-(4-nitrophenyl)-2-oxo-ethyl]propanedioate Dimethyl 2-[2-(tert-butylamino)-1-(4-nitrophenyl)-2-oxidanylidene-ethyl]propanedioate
Wiley ID 1622898