John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=CbpdQIbDJuM SpectraBase Spectrum ID=116xVulCfDk

(accessed ).
1,4-diheptylpiperazine, 1,4-dioxide, dihydrate
SpectraBase Compound ID CbpdQIbDJuM
InChI InChI=1S/C18H40N2O2.2H2O/c1-3-5-7-9-11-13-19(21)15-17-20(22,18-16-19)14-12-10-8-6-4-2;;/h21-22H,3-18H2,1-2H3;2*1H2
InChIKey ZWEBPEAYUYQWSF-UHFFFAOYSA-N
Mol Weight 350.544 g/mol
Molecular Formula C18H42N2O4
Exact Mass 350.314458 g/mol

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

1H Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 116xVulCfDk
Name 1,4-diheptylpiperazine, 1,4-dioxide, dihydrate
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Formula C18H42N2O4
InChI InChI=1S/C18H40N2O2.2H2O/c1-3-5-7-9-11-13-19(21)15-17-20(22,18-16-19)14-12-10-8-6-4-2;;/h21-22H,3-18H2,1-2H3;2*1H2
InChIKey ZWEBPEAYUYQWSF-UHFFFAOYSA-N
Instrument Name Varian CFT-20
Sadtler NMR Number 42661M
Solvent CDCl3
SpectraBase Batch ID APYrX8hDCDi