######################### # 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 bmse011509 _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 bmse011509 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 bmse011509 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011509 1 2 bmse011509 1 3 bmse011509 1 4 bmse011509 1 5 bmse011509 1 6 bmse011509 1 7 bmse011509 1 8 bmse011509 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 bmse011509 1 2 1 3.3548 10_sept_Q2 bmse011509 1 3 1 7.2927 8,9_d bmse011509 1 4 1 1.2705 13,14_m bmse011509 1 5 1 2.6029 DMSO bmse011509 1 6 1 4.0565 3_s bmse011509 1 7 1 2.8143 11,12_s_Q1 bmse011509 1 8 1 6.9214 4,5_m_Q3 bmse011509 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 bmse011509 1 2 2 1 6.6024 bmse011509 1 3 3 1 8.5831 bmse011509 1 4 4 1 6.6024 bmse011509 1 5 5 1 1.9807 bmse011509 1 6 6 1 0.0000 bmse011509 1 7 7 1 0.0000 bmse011509 1 8 8 1 2.9270 bmse011509 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011509 1 2 bmse011509 1 3 bmse011509 1 4 bmse011509 1 5 bmse011509 1 6 bmse011509 1 7 bmse011509 1 8 bmse011509 1 9 bmse011509 1 10 bmse011509 1 11 bmse011509 1 12 bmse011509 1 13 bmse011509 1 14 bmse011509 1 15 bmse011509 1 16 bmse011509 1 17 bmse011509 1 18 bmse011509 1 19 bmse011509 1 20 bmse011509 1 21 bmse011509 1 22 bmse011509 1 23 bmse011509 1 24 bmse011509 1 25 bmse011509 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 bmse011509 1 2 1 3.3218 bmse011509 1 3 1 3.3328 bmse011509 1 4 1 3.3440 bmse011509 1 5 1 3.3548 bmse011509 1 6 1 3.3658 bmse011509 1 7 1 3.3768 bmse011509 1 8 1 3.3878 bmse011509 1 9 1 7.2856 bmse011509 1 10 1 7.2999 bmse011509 1 11 1 1.2760 bmse011509 1 12 1 1.2650 bmse011509 1 13 1 2.5963 bmse011509 1 14 1 2.6000 bmse011509 1 15 1 2.6029 bmse011509 1 16 1 2.6056 bmse011509 1 17 1 2.6095 bmse011509 1 18 1 4.0565 bmse011509 1 19 1 2.8143 bmse011509 1 20 1 6.9090 bmse011509 1 21 1 6.9141 bmse011509 1 22 1 6.9178 bmse011509 1 23 1 6.9247 bmse011509 1 24 1 6.9286 bmse011509 1 25 1 6.9334 bmse011509 1 stop_ save_