######################### # Spectral peak lists # ######################### save_spectral_peaks_1D_1H _Spectral_peak_list.Sf_category spectral_peak_list _Spectral_peak_list.Sf_framecode spectral_peaks_1D_1H _Spectral_peak_list.Entry_ID bmse011487 _Spectral_peak_list.ID 1 _Spectral_peak_list.Sample_ID 1 _Spectral_peak_list.Sample_label $sample_1 _Spectral_peak_list.Sample_condition_list_ID 1 _Spectral_peak_list.Sample_condition_list_label $sample_conditions_1 _Spectral_peak_list.Experiment_ID 1 _Spectral_peak_list.Experiment_name '1D 1H' _Spectral_peak_list.Number_of_spectral_dimensions 1 _Spectral_peak_list.Assigned_chem_shift_list_ID 1 _Spectral_peak_list.Details 'F1: 1H' loop_ _Spectral_dim.ID _Spectral_dim.Spectrometer_frequency _Spectral_dim.Atom_type _Spectral_dim.Atom_isotope_number _Spectral_dim.Spectral_region _Spectral_dim.Sweep_width _Spectral_dim.Sweep_width_units _Spectral_dim.Entry_ID _Spectral_dim.Spectral_peak_list_ID 1 600.1728185 H 1 'Full H' 12.0157698570257 ppm bmse011487 1 stop_ loop_ _Spectral_peak_software.Software_ID _Spectral_peak_software.Software_label _Spectral_peak_software.Entry_ID _Spectral_peak_software.Spectral_peak_list_ID 1 $software_topspin bmse011487 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011487 1 2 bmse011487 1 3 bmse011487 1 4 bmse011487 1 5 bmse011487 1 6 bmse011487 1 7 bmse011487 1 8 bmse011487 1 stop_ loop_ _Peak_char.Peak_ID _Peak_char.Spectral_dim_ID _Peak_char.Chem_shift_val _Peak_char.Details _Peak_char.Entry_ID _Peak_char.Spectral_peak_list_ID 1 1 3.0357 5_d_Q3 bmse011487 1 2 1 2.6153 DMSO_7_m bmse011487 1 3 1 4.6500 SUP bmse011487 1 4 1 1.0578 8,9,12_m bmse011487 1 5 1 1.2054 8,9_m bmse011487 1 6 1 1.7806 6,10,11_m bmse011487 1 7 1 1.6125 10,11_m_Q2 bmse011487 1 8 1 1.5311 12_m_Q1 bmse011487 1 stop_ loop_ _Peak_coupling.ID _Peak_coupling.Peak_ID _Peak_coupling.Spectral_dim_ID _Peak_coupling.Coupling_val _Peak_coupling.Entry_ID _Peak_coupling.Spectral_peak_list_ID 1 1 1 6.0522 bmse011487 1 2 2 1 90.6922 bmse011487 1 3 3 1 0.0000 bmse011487 1 4 4 1 103.6157 bmse011487 1 5 5 1 3.1754 bmse011487 1 6 6 1 101.3629 bmse011487 1 7 7 1 3.4662 bmse011487 1 8 8 1 3.9064 bmse011487 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011487 1 2 bmse011487 1 3 bmse011487 1 4 bmse011487 1 5 bmse011487 1 6 bmse011487 1 7 bmse011487 1 8 bmse011487 1 9 bmse011487 1 10 bmse011487 1 11 bmse011487 1 12 bmse011487 1 13 bmse011487 1 14 bmse011487 1 15 bmse011487 1 16 bmse011487 1 17 bmse011487 1 18 bmse011487 1 19 bmse011487 1 20 bmse011487 1 21 bmse011487 1 22 bmse011487 1 23 bmse011487 1 24 bmse011487 1 25 bmse011487 1 26 bmse011487 1 27 bmse011487 1 28 bmse011487 1 29 bmse011487 1 30 bmse011487 1 31 bmse011487 1 32 bmse011487 1 33 bmse011487 1 34 bmse011487 1 35 bmse011487 1 36 bmse011487 1 37 bmse011487 1 38 bmse011487 1 stop_ loop_ _Spectral_transition_char.Spectral_transition_ID _Spectral_transition_char.Spectral_dim_ID _Spectral_transition_char.Chem_shift_val _Spectral_transition_char.Entry_ID _Spectral_transition_char.Spectral_peak_list_ID 1 1 3.0306 bmse011487 1 2 1 3.0407 bmse011487 1 3 1 2.6908 bmse011487 1 4 1 2.5397 bmse011487 1 5 1 4.6500 bmse011487 1 6 1 1.1441 bmse011487 1 7 1 0.9714 bmse011487 1 8 1 1.2425 bmse011487 1 9 1 1.2421 bmse011487 1 10 1 1.2366 bmse011487 1 11 1 1.2305 bmse011487 1 12 1 1.2221 bmse011487 1 13 1 1.2217 bmse011487 1 14 1 1.2162 bmse011487 1 15 1 1.2107 bmse011487 1 16 1 1.2104 bmse011487 1 17 1 1.1997 bmse011487 1 18 1 1.1950 bmse011487 1 19 1 1.1902 bmse011487 1 20 1 1.1790 bmse011487 1 21 1 1.1739 bmse011487 1 22 1 1.1684 bmse011487 1 23 1 1.8650 bmse011487 1 24 1 1.6961 bmse011487 1 25 1 1.6299 bmse011487 1 26 1 1.6236 bmse011487 1 27 1 1.6176 bmse011487 1 28 1 1.6070 bmse011487 1 29 1 1.6007 bmse011487 1 30 1 1.5994 bmse011487 1 31 1 1.5952 bmse011487 1 32 1 1.5507 bmse011487 1 33 1 1.5448 bmse011487 1 34 1 1.5386 bmse011487 1 35 1 1.5296 bmse011487 1 36 1 1.5232 bmse011487 1 37 1 1.5171 bmse011487 1 38 1 1.5116 bmse011487 1 stop_ save_