######################### # 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 bmse011383 _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 bmse011383 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 bmse011383 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011383 1 2 bmse011383 1 3 bmse011383 1 4 bmse011383 1 5 bmse011383 1 7 bmse011383 1 8 bmse011383 1 9 bmse011383 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 bmse011383 1 2 1 7.1914 14,15_m_Q3 bmse011383 1 3 1 3.5251 16_q bmse011383 1 4 1 2.6031 DMSO bmse011383 1 5 1 6.5120 7_dd_Q1 bmse011383 1 6 1 2.8090 17_t bmse011383 1 7 1 6.9728 4,12,13_m_Q2 bmse011383 1 8 1 7.5473 6_d bmse011383 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 bmse011383 1 2 2 1 4.6583 bmse011383 1 3 3 1 6.5290 bmse011383 1 4 4 1 1.8156 bmse011383 1 5 5 1 3.5213 bmse011383 1 6 5 1 1.7606 bmse011383 1 7 6 1 6.7124 bmse011383 1 8 7 1 43.1910 bmse011383 1 9 8 1 0.9904 bmse011383 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011383 1 2 bmse011383 1 3 bmse011383 1 4 bmse011383 1 5 bmse011383 1 6 bmse011383 1 7 bmse011383 1 8 bmse011383 1 9 bmse011383 1 10 bmse011383 1 11 bmse011383 1 12 bmse011383 1 13 bmse011383 1 14 bmse011383 1 15 bmse011383 1 16 bmse011383 1 17 bmse011383 1 18 bmse011383 1 19 bmse011383 1 20 bmse011383 1 21 bmse011383 1 22 bmse011383 1 23 bmse011383 1 24 bmse011383 1 25 bmse011383 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 bmse011383 1 2 1 7.2031 bmse011383 1 3 1 7.1937 bmse011383 1 4 1 7.1891 bmse011383 1 5 1 7.1798 bmse011383 1 6 1 3.5088 bmse011383 1 7 1 3.5198 bmse011383 1 8 1 3.5306 bmse011383 1 9 1 3.5414 bmse011383 1 10 1 2.5970 bmse011383 1 11 1 2.6000 bmse011383 1 12 1 2.6031 bmse011383 1 13 1 2.6062 bmse011383 1 14 1 2.6091 bmse011383 1 15 1 6.5164 bmse011383 1 16 1 6.5135 bmse011383 1 17 1 6.5106 bmse011383 1 18 1 6.5076 bmse011383 1 19 1 2.7978 bmse011383 1 20 1 2.8090 bmse011383 1 21 1 2.8202 bmse011383 1 22 1 7.0088 bmse011383 1 23 1 6.9368 bmse011383 1 24 1 7.5465 bmse011383 1 25 1 7.5481 bmse011383 1 stop_ save_