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4-Methoxyphenyl-PA-M7:0 [5-(4-Methoxyphenyl)heptyl-N-methylpiperazinamide]
SpectraBase Compound ID CAbA9m9KRq1
InChI InChI=1S/C19H30N2O2/c1-20-13-15-21(16-14-20)19(22)8-6-4-3-5-7-17-9-11-18(23-2)12-10-17/h9-12H,3-8,13-16H2,1-2H3
InChIKey DCSUSSGKLLNNOU-UHFFFAOYSA-N
Mol Weight 318.46 g/mol
Molecular Formula C19H30N2O2
Exact Mass 318.230728 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BCg7DhFrR68
Name 4-Methoxyphenyl-PA-M7:0 [5-(4-Methoxyphenyl)heptyl-N-methylpiperazinamide]
Alternate Name(s) 7-(4-methoxyphenyl)-1-(4-methyl-1-piperazinyl)-1-heptanone 7-(4-methoxyphenyl)-1-(4-methylpiperazin-1-yl)heptan-1-one
Comments Less than 3 mono-isotopic peaks
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Formula C19H30N2O2
InChI InChI=1S/C19H30N2O2/c1-20-13-15-21(16-14-20)19(22)8-6-4-3-5-7-17-9-11-18(23-2)12-10-17/h9-12H,3-8,13-16H2,1-2H3
InChIKey DCSUSSGKLLNNOU-UHFFFAOYSA-N
Molecular Weight 318.461 g/mol
SMILES C(N1CCN(CC1)C)(=O)CCCCCCc1ccc(cc1)OC
SPLASH splash10-00xr-9006000000-ee29569321253a8ef005
Source of Spectrum E1-45-693-0
Wiley ID 1553827