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2-(3-Cyanopropyl)-1,4-dipiperidin-1-yl-butane-1,4-dione

View entire compound with spectra: 1 MS (GC)

2-(3-Cyanopropyl)-1,4-dipiperidin-1-yl-butane-1,4-dione
SpectraBase Compound ID 48sb6CW0u0v
InChI InChI=1S/C18H29N3O2/c19-10-4-3-9-16(18(23)21-13-7-2-8-14-21)15-17(22)20-11-5-1-6-12-20/h16H,1-9,11-15H2
InChIKey VUOOAKPBLDJUIV-UHFFFAOYSA-N
Mol Weight 319.45 g/mol
Molecular Formula C18H29N3O2
Exact Mass 319.225977 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IsZeP5jKmye
Name 2-(3-Cyanopropyl)-1,4-dipiperidin-1-yl-butane-1,4-dione
Alternate Name(s) 7-Oxo-7-(piperidin-1-yl)-5-(piperidine-1-carbonyl)heptanenitrile 7-Oxo-5-[oxo(1-piperidinyl)methyl]-7-(1-piperidinyl)heptanenitrile 7-Oxo-5-(piperidine-1-carbonyl)-7-piperidin-1-ylheptanenitrile 7-Oxo-5-(piperidine-1-carbonyl)-7-(1-piperidyl)heptanenitrile 7-Oxidanylidene-7-piperidin-1-yl-5-piperidin-1-ylcarbonyl-heptanenitrile
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Formula C18H29N3O2
InChI InChI=1S/C18H29N3O2/c19-10-4-3-9-16(18(23)21-13-7-2-8-14-21)15-17(22)20-11-5-1-6-12-20/h16H,1-9,11-15H2
InChIKey VUOOAKPBLDJUIV-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.200600466
Molecular Weight 319.449 g/mol
SMILES C(CCCC#N)(C(=O)N1CCCCC1)CC(=O)N1CCCCC1
SPLASH splash10-001r-9560000000-ce95f4396d18b75779f4
Source of Spectrum ASC-349-849/SM5-3gb
Wiley ID 1765569