######################### # 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 bmse011288 _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 bmse011288 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 bmse011288 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011288 1 2 bmse011288 1 3 bmse011288 1 4 bmse011288 1 5 bmse011288 1 6 bmse011288 1 7 bmse011288 1 8 bmse011288 1 9 bmse011288 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 3.3633 5,12_m bmse011288 1 2 1 3.7578 3_m_Q2 bmse011288 1 3 1 4.6500 SUP bmse011288 1 4 1 2.6032 DMSO bmse011288 1 5 1 1.0553 9,14,15_m bmse011288 1 6 1 2.7327 13_s_Q1 bmse011288 1 7 1 5.8888 6_m_Q3 bmse011288 1 8 1 2.2654 9,11_m bmse011288 1 9 1 3.1414 3,11_m bmse011288 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 68.1844 bmse011288 1 2 2 1 6.8665 bmse011288 1 3 3 1 0.0000 bmse011288 1 4 4 1 1.9532 bmse011288 1 5 5 1 74.7103 bmse011288 1 6 6 1 0.0000 bmse011288 1 7 7 1 7.7028 bmse011288 1 8 8 1 119.9217 bmse011288 1 9 9 1 78.2929 bmse011288 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011288 1 2 bmse011288 1 3 bmse011288 1 4 bmse011288 1 5 bmse011288 1 6 bmse011288 1 7 bmse011288 1 8 bmse011288 1 9 bmse011288 1 10 bmse011288 1 11 bmse011288 1 12 bmse011288 1 13 bmse011288 1 14 bmse011288 1 15 bmse011288 1 16 bmse011288 1 17 bmse011288 1 18 bmse011288 1 19 bmse011288 1 20 bmse011288 1 21 bmse011288 1 22 bmse011288 1 23 bmse011288 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 3.4201 bmse011288 1 2 1 3.3065 bmse011288 1 3 1 3.7864 bmse011288 1 4 1 3.7752 bmse011288 1 5 1 3.7640 bmse011288 1 6 1 3.7527 bmse011288 1 7 1 3.7404 bmse011288 1 8 1 3.7292 bmse011288 1 9 1 4.6500 bmse011288 1 10 1 2.5967 bmse011288 1 11 1 2.6001 bmse011288 1 12 1 2.6033 bmse011288 1 13 1 2.6062 bmse011288 1 14 1 2.6097 bmse011288 1 15 1 1.1175 bmse011288 1 16 1 0.9930 bmse011288 1 17 1 2.7327 bmse011288 1 18 1 5.8953 bmse011288 1 19 1 5.8824 bmse011288 1 20 1 2.3653 bmse011288 1 21 1 2.1655 bmse011288 1 22 1 3.2066 bmse011288 1 23 1 3.0762 bmse011288 1 stop_ save_