######################### # 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 bmse011389 _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 bmse011389 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 bmse011389 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011389 1 2 bmse011389 1 3 bmse011389 1 4 bmse011389 1 5 bmse011389 1 6 bmse011389 1 7 bmse011389 1 8 bmse011389 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 bmse011389 1 2 1 3.3297 14_t_Q2 bmse011389 1 3 1 7.3624 12,13_m bmse011389 1 4 1 7.0707 10,11_m bmse011389 1 5 1 2.0901 16_s bmse011389 1 6 1 1.8640 17,18_m_Q1 bmse011389 1 7 1 2.6031 DMSO bmse011389 1 8 1 3.5070 15_t_Q3 bmse011389 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 bmse011389 1 2 2 1 6.6024 bmse011389 1 3 3 1 4.4016 bmse011389 1 4 4 1 2.9344 bmse011389 1 5 5 1 0.0000 bmse011389 1 6 6 1 71.5679 bmse011389 1 7 7 1 1.8707 bmse011389 1 8 8 1 6.6024 bmse011389 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011389 1 2 bmse011389 1 3 bmse011389 1 4 bmse011389 1 5 bmse011389 1 6 bmse011389 1 7 bmse011389 1 8 bmse011389 1 9 bmse011389 1 10 bmse011389 1 11 bmse011389 1 12 bmse011389 1 13 bmse011389 1 14 bmse011389 1 15 bmse011389 1 16 bmse011389 1 17 bmse011389 1 18 bmse011389 1 19 bmse011389 1 20 bmse011389 1 21 bmse011389 1 22 bmse011389 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 bmse011389 1 2 1 3.3187 bmse011389 1 3 1 3.3297 bmse011389 1 4 1 3.3407 bmse011389 1 5 1 7.3697 bmse011389 1 6 1 7.3584 bmse011389 1 7 1 7.3551 bmse011389 1 8 1 7.0780 bmse011389 1 9 1 7.0747 bmse011389 1 10 1 7.0668 bmse011389 1 11 1 7.0634 bmse011389 1 12 1 2.0901 bmse011389 1 13 1 1.9237 bmse011389 1 14 1 1.8044 bmse011389 1 15 1 2.5968 bmse011389 1 16 1 2.6000 bmse011389 1 17 1 2.6031 bmse011389 1 18 1 2.6062 bmse011389 1 19 1 2.6093 bmse011389 1 20 1 3.4960 bmse011389 1 21 1 3.5070 bmse011389 1 22 1 3.5180 bmse011389 1 stop_ save_