######################### # 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 bmse011684 _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 bmse011684 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 bmse011684 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011684 1 2 bmse011684 1 3 bmse011684 1 4 bmse011684 1 6 bmse011684 1 7 bmse011684 1 8 bmse011684 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 2.6030 DMSO bmse011684 1 2 1 5.8274 2_s bmse011684 1 3 1 4.6500 SUP bmse011684 1 4 1 7.2800 11_dd_Q2 bmse011684 1 5 1 2.0831 12_s bmse011684 1 6 1 7.0670 13,14_m_Q1 bmse011684 1 7 1 7.3610 5_dd_Q3 bmse011684 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 1.7881 bmse011684 1 2 2 1 0.0000 bmse011684 1 3 3 1 0.0000 bmse011684 1 4 4 1 7.9779 bmse011684 1 5 4 1 7.9779 bmse011684 1 6 5 1 0.0000 bmse011684 1 7 6 1 67.6814 bmse011684 1 8 7 1 2.1458 bmse011684 1 9 7 1 2.1458 bmse011684 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011684 1 2 bmse011684 1 3 bmse011684 1 4 bmse011684 1 5 bmse011684 1 6 bmse011684 1 7 bmse011684 1 8 bmse011684 1 9 bmse011684 1 10 bmse011684 1 11 bmse011684 1 12 bmse011684 1 13 bmse011684 1 14 bmse011684 1 15 bmse011684 1 16 bmse011684 1 17 bmse011684 1 18 bmse011684 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 2.5970 bmse011684 1 2 1 2.6000 bmse011684 1 3 1 2.6031 bmse011684 1 4 1 2.6060 bmse011684 1 5 1 2.6089 bmse011684 1 6 1 5.8274 bmse011684 1 7 1 4.6500 bmse011684 1 8 1 7.2933 bmse011684 1 9 1 7.2799 bmse011684 1 10 1 7.2799 bmse011684 1 11 1 7.2667 bmse011684 1 12 1 2.0831 bmse011684 1 13 1 7.1234 bmse011684 1 14 1 7.0106 bmse011684 1 15 1 7.3646 bmse011684 1 16 1 7.3609 bmse011684 1 17 1 7.3609 bmse011684 1 18 1 7.3574 bmse011684 1 stop_ save_