######################### # 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 bmse011257 _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 bmse011257 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 bmse011257 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011257 1 2 bmse011257 1 3 bmse011257 1 4 bmse011257 1 6 bmse011257 1 7 bmse011257 1 8 bmse011257 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 bmse011257 1 2 1 3.0372 13_s bmse011257 1 3 1 2.8282 12_s bmse011257 1 4 1 7.2946 4_dd_Q2 bmse011257 1 5 1 2.6031 DMSO bmse011257 1 6 1 7.1853 10_m_Q1 bmse011257 1 7 1 7.4640 5_dd_Q3 bmse011257 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 bmse011257 1 2 2 1 0.0000 bmse011257 1 3 3 1 0.0000 bmse011257 1 4 4 1 8.4730 bmse011257 1 5 4 1 5.8321 bmse011257 1 6 5 1 1.8156 bmse011257 1 7 6 1 3.8734 bmse011257 1 8 7 1 8.5831 bmse011257 1 9 7 1 2.4209 bmse011257 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011257 1 2 bmse011257 1 3 bmse011257 1 4 bmse011257 1 5 bmse011257 1 6 bmse011257 1 7 bmse011257 1 8 bmse011257 1 9 bmse011257 1 10 bmse011257 1 11 bmse011257 1 12 bmse011257 1 13 bmse011257 1 14 bmse011257 1 15 bmse011257 1 16 bmse011257 1 17 bmse011257 1 18 bmse011257 1 19 bmse011257 1 20 bmse011257 1 21 bmse011257 1 22 bmse011257 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 bmse011257 1 2 1 3.0372 bmse011257 1 3 1 2.8282 bmse011257 1 4 1 7.3065 bmse011257 1 5 1 7.2968 bmse011257 1 6 1 7.2924 bmse011257 1 7 1 7.2826 bmse011257 1 8 1 2.5970 bmse011257 1 9 1 2.6000 bmse011257 1 10 1 2.6031 bmse011257 1 11 1 2.6062 bmse011257 1 12 1 2.6091 bmse011257 1 13 1 7.2014 bmse011257 1 14 1 7.1974 bmse011257 1 15 1 7.1873 bmse011257 1 16 1 7.1833 bmse011257 1 17 1 7.1732 bmse011257 1 18 1 7.1692 bmse011257 1 19 1 7.4731 bmse011257 1 20 1 7.4691 bmse011257 1 21 1 7.4588 bmse011257 1 22 1 7.4548 bmse011257 1 stop_ save_