######################### # 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 bmse011719 _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 bmse011719 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 bmse011719 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011719 1 2 bmse011719 1 4 bmse011719 1 6 bmse011719 1 7 bmse011719 1 8 bmse011719 1 9 bmse011719 1 10 bmse011719 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 bmse011719 1 2 1 7.8687 10_dd bmse011719 1 3 1 7.4796 14_dd_Q1 bmse011719 1 4 1 7.6222 15_m_Q2 bmse011719 1 5 1 7.7604 13_m_Q3 bmse011719 1 6 1 8.5276 8_d bmse011719 1 7 1 6.8245 5_d bmse011719 1 8 1 2.6036 DMSO bmse011719 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 bmse011719 1 2 2 1 1.8156 bmse011719 1 3 2 1 1.8156 bmse011719 1 4 3 1 7.9228 bmse011719 1 5 3 1 7.9228 bmse011719 1 6 4 1 3.7413 bmse011719 1 7 5 1 4.1265 bmse011719 1 8 6 1 1.7606 bmse011719 1 9 7 1 1.1004 bmse011719 1 10 8 1 1.5406 bmse011719 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011719 1 2 bmse011719 1 3 bmse011719 1 4 bmse011719 1 5 bmse011719 1 6 bmse011719 1 7 bmse011719 1 8 bmse011719 1 9 bmse011719 1 10 bmse011719 1 11 bmse011719 1 12 bmse011719 1 13 bmse011719 1 14 bmse011719 1 15 bmse011719 1 16 bmse011719 1 17 bmse011719 1 18 bmse011719 1 19 bmse011719 1 20 bmse011719 1 21 bmse011719 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 bmse011719 1 2 1 7.8717 bmse011719 1 3 1 7.8688 bmse011719 1 4 1 7.8688 bmse011719 1 5 1 7.8657 bmse011719 1 6 1 7.4928 bmse011719 1 7 1 7.4796 bmse011719 1 8 1 7.4796 bmse011719 1 9 1 7.4664 bmse011719 1 10 1 7.6284 bmse011719 1 11 1 7.6261 bmse011719 1 12 1 7.6160 bmse011719 1 13 1 7.7672 bmse011719 1 14 1 7.7658 bmse011719 1 15 1 7.7535 bmse011719 1 16 1 8.5261 bmse011719 1 17 1 8.5290 bmse011719 1 18 1 6.8235 bmse011719 1 19 1 6.8254 bmse011719 1 20 1 2.6049 bmse011719 1 21 1 2.6023 bmse011719 1 stop_ save_