######################### # 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 bmse011547 _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 bmse011547 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 bmse011547 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011547 1 2 bmse011547 1 3 bmse011547 1 4 bmse011547 1 5 bmse011547 1 7 bmse011547 1 8 bmse011547 1 9 bmse011547 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 1.0426 d_6H_Q1 bmse011547 1 2 1 2.7334 Imp2 bmse011547 1 3 1 4.6500 SUP bmse011547 1 4 1 8.2265 s_2H bmse011547 1 5 1 3.6295 dd_2H bmse011547 1 6 1 3.5554 m_2H bmse011547 1 7 1 2.6023 DMSO bmse011547 1 8 1 2.8513 s_6H bmse011547 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 6.6024 bmse011547 1 2 2 1 0.0000 bmse011547 1 3 3 1 0.0000 bmse011547 1 4 4 1 0.0000 bmse011547 1 5 5 1 11.5541 bmse011547 1 6 5 1 9.3533 bmse011547 1 7 6 1 5.5020 bmse011547 1 8 7 1 0.0000 bmse011547 1 9 8 1 0.0000 bmse011547 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011547 1 2 bmse011547 1 3 bmse011547 1 4 bmse011547 1 5 bmse011547 1 6 bmse011547 1 7 bmse011547 1 8 bmse011547 1 9 bmse011547 1 10 bmse011547 1 11 bmse011547 1 12 bmse011547 1 13 bmse011547 1 14 bmse011547 1 15 bmse011547 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 1.0371 bmse011547 1 2 1 1.0481 bmse011547 1 3 1 2.7334 bmse011547 1 4 1 4.6500 bmse011547 1 5 1 8.2265 bmse011547 1 6 1 3.6469 bmse011547 1 7 1 3.6311 bmse011547 1 8 1 3.6274 bmse011547 1 9 1 3.6120 bmse011547 1 10 1 3.5691 bmse011547 1 11 1 3.5614 bmse011547 1 12 1 3.5495 bmse011547 1 13 1 3.5416 bmse011547 1 14 1 2.6023 bmse011547 1 15 1 2.8513 bmse011547 1 stop_ save_