######################### # 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 bmse011450 _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 bmse011450 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 bmse011450 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011450 1 2 bmse011450 1 3 bmse011450 1 4 bmse011450 1 5 bmse011450 1 6 bmse011450 1 7 bmse011450 1 8 bmse011450 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 bmse011450 1 2 1 3.7904 s_2H bmse011450 1 3 1 7.6051 m_2H bmse011450 1 4 1 6.9879 d_1H bmse011450 1 5 1 3.1937 m_9H_Q1 bmse011450 1 6 1 2.7201 Imp2 bmse011450 1 7 1 2.6033 DMSO bmse011450 1 8 1 2.4824 Imp1 bmse011450 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 bmse011450 1 2 2 1 0.0000 bmse011450 1 3 3 1 49.0225 bmse011450 1 4 4 1 1.4305 bmse011450 1 5 5 1 4.4566 bmse011450 1 6 6 1 0.0000 bmse011450 1 7 7 1 1.8707 bmse011450 1 8 8 1 0.0000 bmse011450 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011450 1 2 bmse011450 1 3 bmse011450 1 4 bmse011450 1 5 bmse011450 1 6 bmse011450 1 7 bmse011450 1 8 bmse011450 1 9 bmse011450 1 10 bmse011450 1 11 bmse011450 1 12 bmse011450 1 13 bmse011450 1 14 bmse011450 1 15 bmse011450 1 16 bmse011450 1 17 bmse011450 1 18 bmse011450 1 19 bmse011450 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 bmse011450 1 2 1 3.7904 bmse011450 1 3 1 7.7685 bmse011450 1 4 1 7.6697 bmse011450 1 5 1 7.5709 bmse011450 1 6 1 7.4445 bmse011450 1 7 1 7.4418 bmse011450 1 8 1 6.9867 bmse011450 1 9 1 6.9891 bmse011450 1 10 1 3.2012 bmse011450 1 11 1 3.1949 bmse011450 1 12 1 3.1863 bmse011450 1 13 1 2.7201 bmse011450 1 14 1 2.5970 bmse011450 1 15 1 2.6001 bmse011450 1 16 1 2.6033 bmse011450 1 17 1 2.6064 bmse011450 1 18 1 2.6095 bmse011450 1 19 1 2.4824 bmse011450 1 stop_ save_