######################### # 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 bmse011376 _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 bmse011376 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 bmse011376 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011376 1 2 bmse011376 1 3 bmse011376 1 4 bmse011376 1 6 bmse011376 1 7 bmse011376 1 8 bmse011376 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 2.6032 DMSO bmse011376 1 2 1 6.8327 11,13_m bmse011376 1 3 1 4.6500 SUP bmse011376 1 4 1 7.0947 8_dd_Q3 bmse011376 1 5 1 6.9799 12_m bmse011376 1 6 1 3.8277 9,10_m_Q2 bmse011376 1 7 1 2.8433 6,7_m_Q1 bmse011376 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 1.7881 bmse011376 1 2 2 1 42.7709 bmse011376 1 3 3 1 0.0000 bmse011376 1 4 4 1 7.8678 bmse011376 1 5 4 1 1.1554 bmse011376 1 6 5 1 3.2572 bmse011376 1 7 6 1 4.6217 bmse011376 1 8 7 1 4.6217 bmse011376 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011376 1 2 bmse011376 1 3 bmse011376 1 4 bmse011376 1 5 bmse011376 1 6 bmse011376 1 7 bmse011376 1 8 bmse011376 1 9 bmse011376 1 10 bmse011376 1 11 bmse011376 1 12 bmse011376 1 13 bmse011376 1 14 bmse011376 1 15 bmse011376 1 16 bmse011376 1 17 bmse011376 1 18 bmse011376 1 19 bmse011376 1 20 bmse011376 1 21 bmse011376 1 22 bmse011376 1 23 bmse011376 1 24 bmse011376 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 2.5972 bmse011376 1 2 1 2.6001 bmse011376 1 3 1 2.6033 bmse011376 1 4 1 2.6062 bmse011376 1 5 1 2.6091 bmse011376 1 6 1 6.8684 bmse011376 1 7 1 6.7971 bmse011376 1 8 1 4.6500 bmse011376 1 9 1 7.1022 bmse011376 1 10 1 7.1004 bmse011376 1 11 1 7.0892 bmse011376 1 12 1 7.0872 bmse011376 1 13 1 6.9935 bmse011376 1 14 1 6.9915 bmse011376 1 15 1 6.9807 bmse011376 1 16 1 6.9794 bmse011376 1 17 1 6.9684 bmse011376 1 18 1 6.9664 bmse011376 1 19 1 3.8354 bmse011376 1 20 1 3.8277 bmse011376 1 21 1 3.8200 bmse011376 1 22 1 2.8510 bmse011376 1 23 1 2.8433 bmse011376 1 24 1 2.8356 bmse011376 1 stop_ save_