######################### # 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 bmse011414 _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 bmse011414 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 bmse011414 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011414 1 2 bmse011414 1 3 bmse011414 1 4 bmse011414 1 5 bmse011414 1 6 bmse011414 1 7 bmse011414 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 7.1088 9_d_Q3 bmse011414 1 2 1 4.6500 SUP bmse011414 1 3 1 2.6029 DMSO bmse011414 1 4 1 1.6513 14,15_m_Q1 bmse011414 1 5 1 2.1935 13,14,15_m bmse011414 1 6 1 3.0592 12_m_Q2 bmse011414 1 7 1 7.7910 7_d bmse011414 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 9.6835 bmse011414 1 2 2 1 0.0000 bmse011414 1 3 3 1 1.9807 bmse011414 1 4 4 1 3.5551 bmse011414 1 5 5 1 101.2244 bmse011414 1 6 6 1 0.0000 bmse011414 1 7 7 1 9.5734 bmse011414 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011414 1 2 bmse011414 1 3 bmse011414 1 4 bmse011414 1 5 bmse011414 1 6 bmse011414 1 7 bmse011414 1 8 bmse011414 1 9 bmse011414 1 10 bmse011414 1 11 bmse011414 1 12 bmse011414 1 13 bmse011414 1 14 bmse011414 1 15 bmse011414 1 16 bmse011414 1 17 bmse011414 1 18 bmse011414 1 19 bmse011414 1 20 bmse011414 1 21 bmse011414 1 22 bmse011414 1 23 bmse011414 1 24 bmse011414 1 25 bmse011414 1 26 bmse011414 1 27 bmse011414 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 7.1008 bmse011414 1 2 1 7.1169 bmse011414 1 3 1 4.6500 bmse011414 1 4 1 2.5963 bmse011414 1 5 1 2.6001 bmse011414 1 6 1 2.6029 bmse011414 1 7 1 2.6058 bmse011414 1 8 1 2.6095 bmse011414 1 9 1 1.6898 bmse011414 1 10 1 1.6783 bmse011414 1 11 1 1.6779 bmse011414 1 12 1 1.6730 bmse011414 1 13 1 1.6610 bmse011414 1 14 1 1.6565 bmse011414 1 15 1 1.6561 bmse011414 1 16 1 1.6482 bmse011414 1 17 1 1.6436 bmse011414 1 18 1 1.6383 bmse011414 1 19 1 1.6306 bmse011414 1 20 1 1.6260 bmse011414 1 21 1 1.6255 bmse011414 1 22 1 1.6128 bmse011414 1 23 1 2.2778 bmse011414 1 24 1 2.1092 bmse011414 1 25 1 3.0592 bmse011414 1 26 1 7.7830 bmse011414 1 27 1 7.7989 bmse011414 1 stop_ save_