######################### # 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 bmse011005 _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 bmse011005 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 bmse011005 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011005 1 2 bmse011005 1 3 bmse011005 1 4 bmse011005 1 5 bmse011005 1 6 bmse011005 1 7 bmse011005 1 8 bmse011005 1 9 bmse011005 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 6.0119 d_1H bmse011005 1 2 1 1.3642 d_6H bmse011005 1 3 1 2.6030 DMSO bmse011005 1 4 1 7.3286 m_4H_Q1 bmse011005 1 5 1 6.2799 t_1H bmse011005 1 6 1 2.7193 Imp2 bmse011005 1 7 1 3.8200 m_2H bmse011005 1 8 1 7.0663 m_3H bmse011005 1 9 1 8.2942 s_1H bmse011005 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 3.0811 bmse011005 1 2 2 1 7.0425 bmse011005 1 3 3 1 1.9532 bmse011005 1 4 4 1 4.9243 bmse011005 1 5 5 1 2.4209 bmse011005 1 6 6 1 0.0000 bmse011005 1 7 7 1 7.0425 bmse011005 1 8 8 1 8.1979 bmse011005 1 9 9 1 0.0000 bmse011005 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011005 1 2 bmse011005 1 3 bmse011005 1 4 bmse011005 1 5 bmse011005 1 6 bmse011005 1 7 bmse011005 1 8 bmse011005 1 9 bmse011005 1 10 bmse011005 1 11 bmse011005 1 12 bmse011005 1 13 bmse011005 1 14 bmse011005 1 15 bmse011005 1 16 bmse011005 1 17 bmse011005 1 18 bmse011005 1 19 bmse011005 1 20 bmse011005 1 21 bmse011005 1 22 bmse011005 1 23 bmse011005 1 24 bmse011005 1 25 bmse011005 1 26 bmse011005 1 27 bmse011005 1 28 bmse011005 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 6.0093 bmse011005 1 2 1 6.0144 bmse011005 1 3 1 1.3583 bmse011005 1 4 1 1.3701 bmse011005 1 5 1 2.5965 bmse011005 1 6 1 2.6000 bmse011005 1 7 1 2.6031 bmse011005 1 8 1 2.6060 bmse011005 1 9 1 2.6095 bmse011005 1 10 1 7.3450 bmse011005 1 11 1 7.3325 bmse011005 1 12 1 7.3219 bmse011005 1 13 1 7.3151 bmse011005 1 14 1 7.3122 bmse011005 1 15 1 6.2759 bmse011005 1 16 1 6.2797 bmse011005 1 17 1 6.2840 bmse011005 1 18 1 2.7193 bmse011005 1 19 1 3.8376 bmse011005 1 20 1 3.8258 bmse011005 1 21 1 3.8141 bmse011005 1 22 1 3.8024 bmse011005 1 23 1 7.0936 bmse011005 1 24 1 7.0789 bmse011005 1 25 1 7.0639 bmse011005 1 26 1 7.0513 bmse011005 1 27 1 7.0390 bmse011005 1 28 1 8.2942 bmse011005 1 stop_ save_