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Dimethyl 12,12'-(piperazine-1,4-diyl)didodecanoate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

Dimethyl 12,12'-(piperazine-1,4-diyl)didodecanoate
SpectraBase Compound ID 7AXC1VnpLAm
InChI InChI=1S/C30H58N2O4/c1-35-29(33)21-17-13-9-5-3-7-11-15-19-23-31-25-27-32(28-26-31)24-20-16-12-8-4-6-10-14-18-22-30(34)36-2/h3-28H2,1-2H3
InChIKey ZLVGFSXDEIHPQX-UHFFFAOYSA-N
Mol Weight 510.8 g/mol
Molecular Formula C30H58N2O4
Exact Mass 510.439658 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID JtWjf7O6n3Y
Name Dimethyl 12,12'-(piperazine-1,4-diyl)didodecanoate
Comments Computed using HOSE algorithm
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Exact Mass 510.439658352 u
Formula C30H58N2O4
InChI InChI=1S/C30H58N2O4/c1-35-29(33)21-17-13-9-5-3-7-11-15-19-23-31-25-27-32(28-26-31)24-20-16-12-8-4-6-10-14-18-22-30(34)36-2/h3-28H2,1-2H3
InChIKey ZLVGFSXDEIHPQX-UHFFFAOYSA-N
Molecular Weight 510.804 g/mol
SMILES C(N1CCN(CCCCCCCCCCCC(OC)=O)CC1)CCCCCCCCCCC(OC)=O