######################### # 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 bmse011419 _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 bmse011419 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 bmse011419 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011419 1 2 bmse011419 1 3 bmse011419 1 4 bmse011419 1 5 bmse011419 1 6 bmse011419 1 7 bmse011419 1 8 bmse011419 1 10 bmse011419 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 4.6500 SUP bmse011419 1 2 1 6.9130 10_d bmse011419 1 3 1 2.6030 DMSO bmse011419 1 4 1 1.7984 15_m bmse011419 1 5 1 6.5344 8_d bmse011419 1 6 1 2.0848 13_s_Q2 bmse011419 1 7 1 3.1551 12_m bmse011419 1 8 1 2.5103 11_dd_Q3 bmse011419 1 9 1 2.0202 14_s_Q1 bmse011419 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 bmse011419 1 2 2 1 7.9228 bmse011419 1 3 3 1 1.9532 bmse011419 1 4 4 1 5.9421 bmse011419 1 5 5 1 7.9228 bmse011419 1 6 6 1 0.0000 bmse011419 1 7 7 1 5.5020 bmse011419 1 8 8 1 6.4923 bmse011419 1 9 8 1 6.4923 bmse011419 1 10 9 1 0.0000 bmse011419 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011419 1 2 bmse011419 1 3 bmse011419 1 4 bmse011419 1 5 bmse011419 1 6 bmse011419 1 7 bmse011419 1 8 bmse011419 1 9 bmse011419 1 10 bmse011419 1 11 bmse011419 1 12 bmse011419 1 13 bmse011419 1 14 bmse011419 1 15 bmse011419 1 16 bmse011419 1 17 bmse011419 1 18 bmse011419 1 19 bmse011419 1 20 bmse011419 1 21 bmse011419 1 22 bmse011419 1 23 bmse011419 1 24 bmse011419 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 4.6500 bmse011419 1 2 1 6.9064 bmse011419 1 3 1 6.9196 bmse011419 1 4 1 2.5965 bmse011419 1 5 1 2.6001 bmse011419 1 6 1 2.6029 bmse011419 1 7 1 2.6058 bmse011419 1 8 1 2.6095 bmse011419 1 9 1 1.8182 bmse011419 1 10 1 1.8075 bmse011419 1 11 1 1.7980 bmse011419 1 12 1 1.7890 bmse011419 1 13 1 1.7786 bmse011419 1 14 1 6.5278 bmse011419 1 15 1 6.5410 bmse011419 1 16 1 2.0848 bmse011419 1 17 1 3.1643 bmse011419 1 18 1 3.1551 bmse011419 1 19 1 3.1460 bmse011419 1 20 1 2.5211 bmse011419 1 21 1 2.5103 bmse011419 1 22 1 2.5103 bmse011419 1 23 1 2.4995 bmse011419 1 24 1 2.0202 bmse011419 1 stop_ save_