######################### # 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 bmse011507 _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 bmse011507 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 bmse011507 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011507 1 2 bmse011507 1 3 bmse011507 1 4 bmse011507 1 5 bmse011507 1 6 bmse011507 1 7 bmse011507 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 bmse011507 1 2 1 2.6990 7_s_Q1 bmse011507 1 3 1 3.6762 5_m_Q3 bmse011507 1 4 1 1.6644 8,9,10,11_m bmse011507 1 5 1 1.4222 10,11,12,13 bmse011507 1 6 1 2.6034 DMSO bmse011507 1 7 1 2.9063 6_s_Q2 bmse011507 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 bmse011507 1 2 2 1 0.0000 bmse011507 1 3 3 1 4.8417 bmse011507 1 4 4 1 147.1581 bmse011507 1 5 5 1 137.8013 bmse011507 1 6 6 1 0.0000 bmse011507 1 7 7 1 0.0000 bmse011507 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011507 1 2 bmse011507 1 3 bmse011507 1 4 bmse011507 1 5 bmse011507 1 6 bmse011507 1 7 bmse011507 1 8 bmse011507 1 9 bmse011507 1 10 bmse011507 1 11 bmse011507 1 12 bmse011507 1 13 bmse011507 1 14 bmse011507 1 15 bmse011507 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 bmse011507 1 2 1 2.6990 bmse011507 1 3 1 3.7004 bmse011507 1 4 1 3.6933 bmse011507 1 5 1 3.6837 bmse011507 1 6 1 3.6762 bmse011507 1 7 1 3.6685 bmse011507 1 8 1 3.6593 bmse011507 1 9 1 3.6520 bmse011507 1 10 1 1.7870 bmse011507 1 11 1 1.5418 bmse011507 1 12 1 1.5370 bmse011507 1 13 1 1.3074 bmse011507 1 14 1 2.6034 bmse011507 1 15 1 2.9063 bmse011507 1 stop_ save_