######################### # 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 bmse011195 _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 bmse011195 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 bmse011195 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011195 1 3 bmse011195 1 4 bmse011195 1 5 bmse011195 1 6 bmse011195 1 7 bmse011195 1 8 bmse011195 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 8.0594 7_dd_Q3 bmse011195 1 2 1 4.6500 SUP bmse011195 1 3 1 8.4924 4_d bmse011195 1 4 1 2.6031 DMSO bmse011195 1 5 1 1.3208 12_t_Q1 bmse011195 1 6 1 6.8727 9_d_Q2 bmse011195 1 7 1 4.2882 11_m bmse011195 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 8.8031 bmse011195 1 2 1 1 2.5309 bmse011195 1 3 2 1 0.0000 bmse011195 1 4 3 1 2.4209 bmse011195 1 5 4 1 1.9807 bmse011195 1 6 5 1 7.0975 bmse011195 1 7 6 1 8.8031 bmse011195 1 8 7 1 7.0425 bmse011195 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011195 1 2 bmse011195 1 3 bmse011195 1 4 bmse011195 1 5 bmse011195 1 6 bmse011195 1 7 bmse011195 1 8 bmse011195 1 9 bmse011195 1 10 bmse011195 1 11 bmse011195 1 12 bmse011195 1 13 bmse011195 1 14 bmse011195 1 15 bmse011195 1 16 bmse011195 1 17 bmse011195 1 18 bmse011195 1 19 bmse011195 1 20 bmse011195 1 21 bmse011195 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 8.0688 bmse011195 1 2 1 8.0646 bmse011195 1 3 1 8.0542 bmse011195 1 4 1 8.0499 bmse011195 1 5 1 4.6500 bmse011195 1 6 1 8.4903 bmse011195 1 7 1 8.4944 bmse011195 1 8 1 2.5965 bmse011195 1 9 1 2.6001 bmse011195 1 10 1 2.6031 bmse011195 1 11 1 2.6060 bmse011195 1 12 1 2.6097 bmse011195 1 13 1 1.3090 bmse011195 1 14 1 1.3209 bmse011195 1 15 1 1.3327 bmse011195 1 16 1 6.8653 bmse011195 1 17 1 6.8800 bmse011195 1 18 1 4.3058 bmse011195 1 19 1 4.2941 bmse011195 1 20 1 4.2824 bmse011195 1 21 1 4.2706 bmse011195 1 stop_ save_