######################### # 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 bmse011341 _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 bmse011341 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 bmse011341 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011341 1 2 bmse011341 1 3 bmse011341 1 4 bmse011341 1 5 bmse011341 1 7 bmse011341 1 8 bmse011341 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 bmse011341 1 2 1 7.3736 9_m bmse011341 1 3 1 7.4626 10,11_d bmse011341 1 4 1 2.6029 DMSO bmse011341 1 5 1 3.2138 12_dd_Q3 bmse011341 1 6 1 1.1739 14_d_Q1 bmse011341 1 7 1 2.9948 12_dd_Q2 bmse011341 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 bmse011341 1 2 2 1 8.1429 bmse011341 1 3 3 1 8.0329 bmse011341 1 4 4 1 1.8707 bmse011341 1 5 5 1 12.8746 bmse011341 1 6 5 1 2.9711 bmse011341 1 7 6 1 6.3823 bmse011341 1 8 7 1 12.8196 bmse011341 1 9 7 1 10.1786 bmse011341 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011341 1 2 bmse011341 1 3 bmse011341 1 4 bmse011341 1 5 bmse011341 1 6 bmse011341 1 7 bmse011341 1 8 bmse011341 1 9 bmse011341 1 10 bmse011341 1 11 bmse011341 1 12 bmse011341 1 13 bmse011341 1 14 bmse011341 1 15 bmse011341 1 16 bmse011341 1 17 bmse011341 1 18 bmse011341 1 19 bmse011341 1 20 bmse011341 1 21 bmse011341 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 bmse011341 1 2 1 7.3871 bmse011341 1 3 1 7.3745 bmse011341 1 4 1 7.3600 bmse011341 1 5 1 7.4559 bmse011341 1 6 1 7.4693 bmse011341 1 7 1 2.5967 bmse011341 1 8 1 2.6001 bmse011341 1 9 1 2.6031 bmse011341 1 10 1 2.6062 bmse011341 1 11 1 2.6091 bmse011341 1 12 1 3.2270 bmse011341 1 13 1 3.2221 bmse011341 1 14 1 3.2056 bmse011341 1 15 1 3.2006 bmse011341 1 16 1 1.1686 bmse011341 1 17 1 1.1792 bmse011341 1 18 1 3.0140 bmse011341 1 19 1 2.9971 bmse011341 1 20 1 2.9927 bmse011341 1 21 1 2.9756 bmse011341 1 stop_ save_