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Diethyl (m-Nitrophenacyl)acetamidomalonate
SpectraBase Compound ID KN4Ut3SznoY
InChI InChI=1S/C17H20N2O8/c1-3-26-16(22)15(17(23)27-4-2)18-14(21)9-8-13(20)11-6-5-7-12(10-11)19(24)25/h5-7,10,15H,3-4,8-9H2,1-2H3,(H,18,21)
InChIKey PSAFJEMMJXERRW-UHFFFAOYSA-N
Mol Weight 380.35 g/mol
Molecular Formula C17H20N2O8
Exact Mass 380.121966 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KVRbLyV2Y09
Name Diethyl (m-Nitrophenacyl)acetamidomalonate
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Formula C17H20N2O8
InChI InChI=1S/C17H20N2O8/c1-3-26-16(22)15(17(23)27-4-2)18-14(21)9-8-13(20)11-6-5-7-12(10-11)19(24)25/h5-7,10,15H,3-4,8-9H2,1-2H3,(H,18,21)
InChIKey PSAFJEMMJXERRW-UHFFFAOYSA-N
Molecular Weight 380.353 g/mol
SMILES N(C(C(=O)OCC)C(=O)OCC)C(CCC(c1cc(N(=O)=O)ccc1)=O)=O
SPLASH splash10-0uxr-0970000000-af95d417bea280260c84
Source of Spectrum E1-37-653-3
Synonyms Diethyl 2-{[4-(3-nitrophenyl)-4-oxobutanoyl]amino}malonate
Wiley ID 1574920