######################### # 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 bmse011212 _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 bmse011212 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 bmse011212 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011212 1 2 bmse011212 1 3 bmse011212 1 4 bmse011212 1 5 bmse011212 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 7.9324 11,12_m_Q3 bmse011212 1 2 1 4.6500 SUP bmse011212 1 3 1 2.8662 14_d_Q1 bmse011212 1 4 1 7.8452 9,10_m_Q2 bmse011212 1 5 1 2.6031 DMSO bmse011212 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 2.5089 bmse011212 1 2 2 1 0.0000 bmse011212 1 3 3 1 4.6217 bmse011212 1 4 4 1 2.5309 bmse011212 1 5 5 1 1.8707 bmse011212 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011212 1 2 bmse011212 1 3 bmse011212 1 4 bmse011212 1 5 bmse011212 1 6 bmse011212 1 7 bmse011212 1 8 bmse011212 1 9 bmse011212 1 10 bmse011212 1 11 bmse011212 1 12 bmse011212 1 13 bmse011212 1 14 bmse011212 1 15 bmse011212 1 16 bmse011212 1 17 bmse011212 1 18 bmse011212 1 19 bmse011212 1 20 bmse011212 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 7.9220 bmse011212 1 2 1 7.9255 bmse011212 1 3 1 7.9284 bmse011212 1 4 1 7.9363 bmse011212 1 5 1 7.9394 bmse011212 1 6 1 7.9429 bmse011212 1 7 1 4.6500 bmse011212 1 8 1 2.8623 bmse011212 1 9 1 2.8700 bmse011212 1 10 1 7.8345 bmse011212 1 11 1 7.8382 bmse011212 1 12 1 7.8413 bmse011212 1 13 1 7.8492 bmse011212 1 14 1 7.8523 bmse011212 1 15 1 7.8556 bmse011212 1 16 1 2.5968 bmse011212 1 17 1 2.6000 bmse011212 1 18 1 2.6031 bmse011212 1 19 1 2.6062 bmse011212 1 20 1 2.6093 bmse011212 1 stop_ save_