######################### # 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 bmse011702 _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 bmse011702 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 bmse011702 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011702 1 2 bmse011702 1 3 bmse011702 1 4 bmse011702 1 5 bmse011702 1 7 bmse011702 1 8 bmse011702 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 bmse011702 1 2 1 7.6558 12_d_Q3 bmse011702 1 3 1 2.6183 DMSO_9,10_m bmse011702 1 4 1 3.3702 6,7_m bmse011702 1 5 1 7.1087 13_dd_Q1 bmse011702 1 6 1 1.2498 14,15,16_m bmse011702 1 7 1 7.4063 11_d_Q2 bmse011702 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 bmse011702 1 2 2 1 4.9518 bmse011702 1 3 3 1 71.0188 bmse011702 1 4 4 1 205.0958 bmse011702 1 5 5 1 4.3466 bmse011702 1 6 5 1 4.3466 bmse011702 1 7 6 1 68.2905 bmse011702 1 8 7 1 3.6313 bmse011702 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011702 1 2 bmse011702 1 3 bmse011702 1 4 bmse011702 1 5 bmse011702 1 6 bmse011702 1 7 bmse011702 1 8 bmse011702 1 9 bmse011702 1 10 bmse011702 1 11 bmse011702 1 12 bmse011702 1 13 bmse011702 1 14 bmse011702 1 15 bmse011702 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 bmse011702 1 2 1 7.6517 bmse011702 1 3 1 7.6600 bmse011702 1 4 1 2.6775 bmse011702 1 5 1 2.5591 bmse011702 1 6 1 3.5411 bmse011702 1 7 1 3.1993 bmse011702 1 8 1 7.1160 bmse011702 1 9 1 7.1094 bmse011702 1 10 1 7.1094 bmse011702 1 11 1 7.1015 bmse011702 1 12 1 1.3067 bmse011702 1 13 1 1.1929 bmse011702 1 14 1 7.4033 bmse011702 1 15 1 7.4093 bmse011702 1 stop_ save_