######################### # 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 bmse011236 _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 bmse011236 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 bmse011236 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011236 1 3 bmse011236 1 4 bmse011236 1 5 bmse011236 1 6 bmse011236 1 7 bmse011236 1 8 bmse011236 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 7.1074 6_dd_Q3 bmse011236 1 2 1 7.4524 5,8_m bmse011236 1 3 1 1.1136 15_m_Q1 bmse011236 1 4 1 3.2977 14_m bmse011236 1 5 1 4.6500 SUP bmse011236 1 6 1 2.6031 DMSO bmse011236 1 7 1 2.7560 12,13_s_Q2 bmse011236 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 8.6931 bmse011236 1 2 1 1 8.6931 bmse011236 1 3 2 1 49.3197 bmse011236 1 4 3 1 7.2626 bmse011236 1 5 4 1 5.5570 bmse011236 1 6 5 1 0.0000 bmse011236 1 7 6 1 1.8707 bmse011236 1 8 7 1 0.0000 bmse011236 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011236 1 2 bmse011236 1 3 bmse011236 1 4 bmse011236 1 5 bmse011236 1 6 bmse011236 1 7 bmse011236 1 8 bmse011236 1 9 bmse011236 1 10 bmse011236 1 11 bmse011236 1 12 bmse011236 1 13 bmse011236 1 14 bmse011236 1 15 bmse011236 1 16 bmse011236 1 17 bmse011236 1 18 bmse011236 1 19 bmse011236 1 20 bmse011236 1 21 bmse011236 1 22 bmse011236 1 23 bmse011236 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 7.1218 bmse011236 1 2 1 7.1074 bmse011236 1 3 1 7.1074 bmse011236 1 4 1 7.0929 bmse011236 1 5 1 7.4935 bmse011236 1 6 1 7.4113 bmse011236 1 7 1 1.1257 bmse011236 1 8 1 1.1136 bmse011236 1 9 1 1.1015 bmse011236 1 10 1 3.3255 bmse011236 1 11 1 3.3134 bmse011236 1 12 1 3.3036 bmse011236 1 13 1 3.3011 bmse011236 1 14 1 3.2915 bmse011236 1 15 1 3.2794 bmse011236 1 16 1 3.2699 bmse011236 1 17 1 4.6500 bmse011236 1 18 1 2.5968 bmse011236 1 19 1 2.6000 bmse011236 1 20 1 2.6031 bmse011236 1 21 1 2.6062 bmse011236 1 22 1 2.6093 bmse011236 1 23 1 2.7560 bmse011236 1 stop_ save_