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2-[[(2-ketocyclohepta[b]pyrrol-1-yl)amino]methylene]malonic acid diethyl ester
SpectraBase Compound ID 4xUqMOI6Pkp
InChI InChI=1S/C17H18N2O5/c1-3-23-16(21)13(17(22)24-4-2)11-18-19-14-9-7-5-6-8-12(14)10-15(19)20/h5-11,18H,3-4H2,1-2H3
InChIKey UZRVIKOIHITCQF-UHFFFAOYSA-N
Mol Weight 330.34 g/mol
Molecular Formula C17H18N2O5
Exact Mass 330.121572 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jc9gVNkhypw
Name 2-[[(2-ketocyclohepta[b]pyrrol-1-yl)amino]methylene]malonic acid diethyl ester
Alternate Name(s) 2-[[(2-oxo-1-cyclohepta[b]pyrrolyl)amino]methylidene]propanedioic acid diethyl ester Diethyl 2-[[(2-oxidanylidenecyclohepta[b]pyrrol-1-yl)amino]methylidene]propanedioate Diethyl 2-[[(2-oxocyclohepta[b]pyrrol-1-yl)amino]methylene]propanedioate Diethyl 2-[[(2-oxocyclohepta[b]pyrrol-1-yl)amino]methylidene]propanedioate
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Formula C17H18N2O5
InChI InChI=1S/C17H18N2O5/c1-3-23-16(21)13(17(22)24-4-2)11-18-19-14-9-7-5-6-8-12(14)10-15(19)20/h5-11,18H,3-4H2,1-2H3
InChIKey UZRVIKOIHITCQF-UHFFFAOYSA-N
Molecular Weight 330.340 g/mol
SMILES N(C=C(C(=O)OCC)C(=O)OCC)N1C=2C(C=CC=CC2)=CC1=O
SPLASH splash10-0005-0900000000-e48352666c46e7a6b242
Source of Spectrum KC-0-2193-8
Wiley ID 822920