######################### # 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 bmse011565 _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 bmse011565 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 bmse011565 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011565 1 2 bmse011565 1 3 bmse011565 1 4 bmse011565 1 5 bmse011565 1 6 bmse011565 1 7 bmse011565 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 1.3189 m_6H_Q1 bmse011565 1 2 1 4.6500 SUP bmse011565 1 3 1 2.4856 Imp1 bmse011565 1 4 1 2.6030 DMSO bmse011565 1 5 1 3.0584 s_2H bmse011565 1 6 1 2.7191 Imp2 bmse011565 1 7 1 3.2145 m_2H bmse011565 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 12.8746 bmse011565 1 2 2 1 0.0000 bmse011565 1 3 3 1 0.0000 bmse011565 1 4 4 1 1.8432 bmse011565 1 5 5 1 0.0000 bmse011565 1 6 6 1 0.0000 bmse011565 1 7 7 1 7.5539 bmse011565 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011565 1 2 bmse011565 1 3 bmse011565 1 4 bmse011565 1 5 bmse011565 1 6 bmse011565 1 7 bmse011565 1 8 bmse011565 1 9 bmse011565 1 10 bmse011565 1 11 bmse011565 1 12 bmse011565 1 13 bmse011565 1 14 bmse011565 1 15 bmse011565 1 16 bmse011565 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 1.3404 bmse011565 1 2 1 1.3189 bmse011565 1 3 1 1.2975 bmse011565 1 4 1 4.6500 bmse011565 1 5 1 2.4856 bmse011565 1 6 1 2.5968 bmse011565 1 7 1 2.5998 bmse011565 1 8 1 2.6029 bmse011565 1 9 1 2.6060 bmse011565 1 10 1 2.6091 bmse011565 1 11 1 3.0584 bmse011565 1 12 1 2.7191 bmse011565 1 13 1 3.2334 bmse011565 1 14 1 3.2142 bmse011565 1 15 1 3.2046 bmse011565 1 16 1 3.1957 bmse011565 1 stop_ save_