######################### # 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 bmse011102 _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 bmse011102 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 bmse011102 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011102 1 2 bmse011102 1 3 bmse011102 1 4 bmse011102 1 5 bmse011102 1 6 bmse011102 1 7 bmse011102 1 8 bmse011102 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 bmse011102 1 2 1 3.4901 m_1H bmse011102 1 3 1 6.1629 s_1H bmse011102 1 4 1 1.9728 m_4H_Q1 bmse011102 1 5 1 2.3270 m_6H bmse011102 1 6 1 3.4093 m_1H bmse011102 1 7 1 2.9672 s_4H bmse011102 1 8 1 2.6031 DMSO bmse011102 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 bmse011102 1 2 2 1 4.4016 bmse011102 1 3 3 1 0.0000 bmse011102 1 4 4 1 6.0247 bmse011102 1 5 5 1 0.0000 bmse011102 1 6 6 1 5.9696 bmse011102 1 7 7 1 0.0000 bmse011102 1 8 8 1 1.9807 bmse011102 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011102 1 2 bmse011102 1 3 bmse011102 1 4 bmse011102 1 5 bmse011102 1 6 bmse011102 1 7 bmse011102 1 8 bmse011102 1 9 bmse011102 1 10 bmse011102 1 11 bmse011102 1 12 bmse011102 1 13 bmse011102 1 14 bmse011102 1 15 bmse011102 1 16 bmse011102 1 17 bmse011102 1 18 bmse011102 1 19 bmse011102 1 20 bmse011102 1 21 bmse011102 1 22 bmse011102 1 23 bmse011102 1 24 bmse011102 1 25 bmse011102 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 bmse011102 1 2 1 3.5084 bmse011102 1 3 1 3.4974 bmse011102 1 4 1 3.4921 bmse011102 1 5 1 3.4885 bmse011102 1 6 1 3.4817 bmse011102 1 7 1 3.4718 bmse011102 1 8 1 6.1629 bmse011102 1 9 1 1.9929 bmse011102 1 10 1 1.9826 bmse011102 1 11 1 1.9718 bmse011102 1 12 1 1.9645 bmse011102 1 13 1 1.9527 bmse011102 1 14 1 2.3270 bmse011102 1 15 1 3.4292 bmse011102 1 16 1 3.4179 bmse011102 1 17 1 3.4060 bmse011102 1 18 1 3.4016 bmse011102 1 19 1 3.3895 bmse011102 1 20 1 2.9672 bmse011102 1 21 1 2.5965 bmse011102 1 22 1 2.6003 bmse011102 1 23 1 2.6031 bmse011102 1 24 1 2.6062 bmse011102 1 25 1 2.6097 bmse011102 1 stop_ save_