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ethyl 1-(5-methylpyrimidin-2-yl)piperidine-3-carboxylate
SpectraBase Compound ID 116AtdvI8I5
InChI InChI=1S/C13H19N3O2/c1-3-18-12(17)11-5-4-6-16(9-11)13-14-7-10(2)8-15-13/h7-8,11H,3-6,9H2,1-2H3
InChIKey MJWJXPJTQGSFKF-UHFFFAOYSA-N
Mol Weight 249.31 g/mol
Molecular Formula C13H19N3O2
Exact Mass 249.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7Zxs1msyCY5
Name ethyl 1-(5-methylpyrimidin-2-yl)piperidine-3-carboxylate
Appearance Brown oil
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Exact Mass 249.147726862 u
Formula C13H19N3O2
InChI InChI=1S/C13H19N3O2/c1-3-18-12(17)11-5-4-6-16(9-11)13-14-7-10(2)8-15-13/h7-8,11H,3-6,9H2,1-2H3
InChIKey MJWJXPJTQGSFKF-UHFFFAOYSA-N
Instrument Name FINNIGAN MAT 95Q
Ionization Type EI
Literature Reference DOI 10.1002/anie.202210491
Molecular Weight 249.314 g/mol
Quality 130
Reported Formula C13H19N3O2
SMILES C(C)OC(=O)C1CN(CCC1)C1=NC=C(C=N1)C
SPLASH splash10-004i-1910000000-b044486d94dce8ffa5d0
Source of Spectrum ACI-61-SM62-7k (DOI: 10.1002/anie.202210491)
Wiley ID 1899495