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Diethyl 4-acetoxy-4-ethynyl-6,7-diazabicyclo[3.2.2]non-3-en-6,7-dicarboxylate
SpectraBase Compound ID 2CJu9HBX0iC
InChI InChI=1S/C17H22N2O6/c1-5-17(25-12(4)20)11-10-13-8-9-14(17)19(16(22)24-7-3)18(13)15(21)23-6-2/h1,10-11,13-14H,6-9H2,2-4H3
InChIKey MVBRQKYXXIRJKK-UHFFFAOYSA-N
Mol Weight 350.37 g/mol
Molecular Formula C17H22N2O6
Exact Mass 350.147786 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID G5eP0yTZ2zt
Name Diethyl 4-acetoxy-4-ethynyl-6,7-diazabicyclo[3.2.2]non-3-en-6,7-dicarboxylate
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Formula C17H22N2O6
InChI InChI=1S/C17H22N2O6/c1-5-17(25-12(4)20)11-10-13-8-9-14(17)19(16(22)24-7-3)18(13)15(21)23-6-2/h1,10-11,13-14H,6-9H2,2-4H3
InChIKey MVBRQKYXXIRJKK-UHFFFAOYSA-N
Molecular Weight 350.371 g/mol
SMILES C(N1N(C2C(C=CC1CC2)(C#C)OC(=O)C)C(=O)OCC)(=O)OCC
SPLASH splash10-004i-9000000000-f25885d2981d984947de
Source of Spectrum KC-1992-2219-19
Synonyms Diethyl 4-acetoxy-4-ethynyl-6,7-diazabicyclo[3.2.2]non-2-en-6,7-dicarboxylate Diethyl 4-(acetyloxy)-4-ethynyl-6,7-diazabicyclo[3.2.2]non-2-ene-6,7-dicarboxylate
Wiley ID 776860