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Piperazine, 1-(4-ethoxy-1-naphthylsulfonyl)-4-diphenylmethyl-
SpectraBase Compound ID HLuViGVNP2f
InChI InChI=1S/C29H30N2O3S/c1-2-34-27-17-18-28(26-16-10-9-15-25(26)27)35(32,33)31-21-19-30(20-22-31)29(23-11-5-3-6-12-23)24-13-7-4-8-14-24/h3-18,29H,2,19-22H2,1H3
InChIKey ZWPKECKKOLZLPM-UHFFFAOYSA-N
Mol Weight 486.63 g/mol
Molecular Formula C29H30N2O3S
Exact Mass 486.197714 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID A1vBLiwotvO
Name Piperazine, 1-(4-ethoxy-1-naphthylsulfonyl)-4-diphenylmethyl-
Comments Computed using HOSE algorithm
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Exact Mass 486.197714005 u
Formula C29H30N2O3S
InChI InChI=1S/C29H30N2O3S/c1-2-34-27-17-18-28(26-16-10-9-15-25(26)27)35(32,33)31-21-19-30(20-22-31)29(23-11-5-3-6-12-23)24-13-7-4-8-14-24/h3-18,29H,2,19-22H2,1H3
InChIKey ZWPKECKKOLZLPM-UHFFFAOYSA-N
Molecular Weight 486.630 g/mol
SMILES C1(=CC=CC=C1)C(C1=CC=CC=C1)N1CCN(CC1)S(=O)(=O)C1=C2C(=C(C=C1)OCC)C=CC=C2