######################### # 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 bmse011165 _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 bmse011165 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 bmse011165 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011165 1 2 bmse011165 1 3 bmse011165 1 4 bmse011165 1 5 bmse011165 1 6 bmse011165 1 7 bmse011165 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 2.8561 5_s_Q2 bmse011165 1 2 1 4.6500 SUP bmse011165 1 3 1 2.6033 DMSO bmse011165 1 4 1 7.0262 10,11_m bmse011165 1 5 1 2.7702 14_m_Q1 bmse011165 1 6 1 3.2813 9_m bmse011165 1 7 1 7.2269 12,13_m_Q3 bmse011165 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 0.0000 bmse011165 1 2 2 1 0.0000 bmse011165 1 3 3 1 1.8156 bmse011165 1 4 4 1 3.5433 bmse011165 1 5 5 1 6.8775 bmse011165 1 6 6 1 6.7124 bmse011165 1 7 7 1 4.6950 bmse011165 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011165 1 2 bmse011165 1 3 bmse011165 1 4 bmse011165 1 5 bmse011165 1 6 bmse011165 1 7 bmse011165 1 8 bmse011165 1 9 bmse011165 1 10 bmse011165 1 11 bmse011165 1 12 bmse011165 1 13 bmse011165 1 14 bmse011165 1 15 bmse011165 1 16 bmse011165 1 17 bmse011165 1 18 bmse011165 1 19 bmse011165 1 20 bmse011165 1 21 bmse011165 1 22 bmse011165 1 23 bmse011165 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 2.8561 bmse011165 1 2 1 4.6500 bmse011165 1 3 1 2.5972 bmse011165 1 4 1 2.6001 bmse011165 1 5 1 2.6033 bmse011165 1 6 1 2.6064 bmse011165 1 7 1 2.6093 bmse011165 1 8 1 7.0410 bmse011165 1 9 1 7.0377 bmse011165 1 10 1 7.0302 bmse011165 1 11 1 7.0261 bmse011165 1 12 1 7.0223 bmse011165 1 13 1 7.0115 bmse011165 1 14 1 2.7817 bmse011165 1 15 1 2.7701 bmse011165 1 16 1 2.7587 bmse011165 1 17 1 3.2925 bmse011165 1 18 1 3.2811 bmse011165 1 19 1 3.2701 bmse011165 1 20 1 7.2386 bmse011165 1 21 1 7.2291 bmse011165 1 22 1 7.2245 bmse011165 1 23 1 7.2152 bmse011165 1 stop_ save_