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(1,5-Dimethyl-9-oxo-3,7-diazabicyclo[3.3.1]non-3-yl)oxoacetic acid methyl ester
SpectraBase Compound ID 8GBHqfijhR0
InChI InChI=1S/C12H18N2O4/c1-11-4-13-5-12(2,10(11)17)7-14(6-11)8(15)9(16)18-3/h13H,4-7H2,1-3H3/t11-,12+
InChIKey NBXDILFSHNDOHK-TXEJJXNPSA-N
Mol Weight 254.29 g/mol
Molecular Formula C12H18N2O4
Exact Mass 254.126657 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HSgLKwvsaC8
Name (1,5-Dimethyl-9-oxo-3,7-diazabicyclo[3.3.1]non-3-yl)oxoacetic acid methyl ester
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Formula C12H18N2O4
InChI InChI=1S/C12H18N2O4/c1-11-4-13-5-12(2,10(11)17)7-14(6-11)8(15)9(16)18-3/h13H,4-7H2,1-3H3/t11-,12+
InChIKey NBXDILFSHNDOHK-TXEJJXNPSA-N
Molecular Weight 254.286 g/mol
SMILES N1C[C@]2(CN(C[C@@](C1)(C2=O)C)C(C(=O)OC)=O)C
SPLASH splash10-006x-9700000000-b0ee8aff3bd7ca462209
Synonyms 2-(1,5-dimethyl-9-oxo-3,7-diazabicyclo[3.3.1]nonan-3-yl)-2-oxoacetic acid methyl ester 2-keto-2-(9-keto-1,5-dimethyl-3,7-diazabicyclo[3.3.1]nonan-3-yl)acetic acid methyl ester Methyl 2-(1,5-dimethyl-9-oxidanylidene-3,7-diazabicyclo[3.3.1]nonan-3-yl)-2-oxidanylidene-ethanoate Methyl 2-(1,5-dimethyl-9-oxo-3,7-diazabicyclo[3.3.1]nonan-3-yl)-2-oxo-acetate
Wiley ID 1440426