######################### # 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 bmse011700 _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 bmse011700 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 bmse011700 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011700 1 2 bmse011700 1 3 bmse011700 1 4 bmse011700 1 5 bmse011700 1 6 bmse011700 1 7 bmse011700 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 7.3746 4_d_Q3 bmse011700 1 2 1 4.6500 SUP bmse011700 1 3 1 1.3423 6,12,13_m bmse011700 1 4 1 6.9060 5_d_Q2 bmse011700 1 5 1 3.6147 9,11_m bmse011700 1 6 1 2.6026 DMSO bmse011700 1 7 1 2.1887 10_s_Q1 bmse011700 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 5.1718 bmse011700 1 2 2 1 0.0000 bmse011700 1 3 3 1 52.5090 bmse011700 1 4 4 1 5.1718 bmse011700 1 5 5 1 45.7649 bmse011700 1 6 6 1 1.9532 bmse011700 1 7 7 1 0.0000 bmse011700 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011700 1 2 bmse011700 1 3 bmse011700 1 4 bmse011700 1 5 bmse011700 1 6 bmse011700 1 7 bmse011700 1 8 bmse011700 1 9 bmse011700 1 10 bmse011700 1 11 bmse011700 1 12 bmse011700 1 13 bmse011700 1 14 bmse011700 1 15 bmse011700 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 7.3703 bmse011700 1 2 1 7.3789 bmse011700 1 3 1 4.6500 bmse011700 1 4 1 1.3860 bmse011700 1 5 1 1.2985 bmse011700 1 6 1 6.9016 bmse011700 1 7 1 6.9103 bmse011700 1 8 1 3.6528 bmse011700 1 9 1 3.5765 bmse011700 1 10 1 2.5961 bmse011700 1 11 1 2.5998 bmse011700 1 12 1 2.6027 bmse011700 1 13 1 2.6055 bmse011700 1 14 1 2.6091 bmse011700 1 15 1 2.1887 bmse011700 1 stop_ save_