######################### # 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 bmse011665 _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 bmse011665 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 bmse011665 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011665 1 2 bmse011665 1 3 bmse011665 1 4 bmse011665 1 5 bmse011665 1 7 bmse011665 1 8 bmse011665 1 10 bmse011665 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 2.6030 DMSO bmse011665 1 2 1 4.6500 SUP bmse011665 1 3 1 0.9188 13_t_Q1 bmse011665 1 4 1 7.9613 9_d bmse011665 1 5 1 8.1885 10_dd bmse011665 1 6 1 1.6587 11_m_Q2 bmse011665 1 7 1 2.4085 8_dd_Q3 bmse011665 1 8 1 7.4026 12_dd bmse011665 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 1.9532 bmse011665 1 2 2 1 0.0000 bmse011665 1 3 3 1 7.4277 bmse011665 1 4 4 1 7.8128 bmse011665 1 5 5 1 4.7317 bmse011665 1 6 5 1 1.3205 bmse011665 1 7 6 1 7.4277 bmse011665 1 8 7 1 7.3726 bmse011665 1 9 7 1 7.3726 bmse011665 1 10 8 1 7.9228 bmse011665 1 11 8 1 4.9518 bmse011665 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011665 1 2 bmse011665 1 3 bmse011665 1 4 bmse011665 1 5 bmse011665 1 6 bmse011665 1 7 bmse011665 1 8 bmse011665 1 9 bmse011665 1 10 bmse011665 1 11 bmse011665 1 12 bmse011665 1 13 bmse011665 1 14 bmse011665 1 15 bmse011665 1 16 bmse011665 1 17 bmse011665 1 18 bmse011665 1 19 bmse011665 1 20 bmse011665 1 21 bmse011665 1 22 bmse011665 1 23 bmse011665 1 24 bmse011665 1 25 bmse011665 1 26 bmse011665 1 27 bmse011665 1 28 bmse011665 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 2.5965 bmse011665 1 2 1 2.6000 bmse011665 1 3 1 2.6029 bmse011665 1 4 1 2.6058 bmse011665 1 5 1 2.6095 bmse011665 1 6 1 4.6500 bmse011665 1 7 1 0.9064 bmse011665 1 8 1 0.9187 bmse011665 1 9 1 0.9311 bmse011665 1 10 1 7.9548 bmse011665 1 11 1 7.9678 bmse011665 1 12 1 8.1935 bmse011665 1 13 1 8.1913 bmse011665 1 14 1 8.1856 bmse011665 1 15 1 8.1834 bmse011665 1 16 1 1.6834 bmse011665 1 17 1 1.6709 bmse011665 1 18 1 1.6585 bmse011665 1 19 1 1.6462 bmse011665 1 20 1 1.6339 bmse011665 1 21 1 2.4208 bmse011665 1 22 1 2.4085 bmse011665 1 23 1 2.4085 bmse011665 1 24 1 2.3963 bmse011665 1 25 1 7.4134 bmse011665 1 26 1 7.4051 bmse011665 1 27 1 7.4002 bmse011665 1 28 1 7.3919 bmse011665 1 stop_ save_