######################### # 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 bmse011683 _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 bmse011683 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 bmse011683 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011683 1 2 bmse011683 1 4 bmse011683 1 5 bmse011683 1 6 bmse011683 1 7 bmse011683 1 9 bmse011683 1 10 bmse011683 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 3.9503 15_s_Q1 bmse011683 1 2 1 6.9618 13_dd bmse011683 1 3 1 4.6500 SUP bmse011683 1 4 1 6.6619 6,12_m bmse011683 1 5 1 7.4621 9_d_Q3 bmse011683 1 6 1 7.3045 10_dd bmse011683 1 7 1 2.6029 DMSO bmse011683 1 8 1 7.0241 5_d_Q2 bmse011683 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 bmse011683 1 2 2 1 5.1168 bmse011683 1 3 2 1 3.4662 bmse011683 1 4 3 1 0.0000 bmse011683 1 5 4 1 17.4106 bmse011683 1 6 5 1 2.2008 bmse011683 1 7 6 1 5.0618 bmse011683 1 8 6 1 1.1004 bmse011683 1 9 7 1 1.8707 bmse011683 1 10 8 1 2.8610 bmse011683 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011683 1 2 bmse011683 1 3 bmse011683 1 4 bmse011683 1 5 bmse011683 1 6 bmse011683 1 7 bmse011683 1 8 bmse011683 1 9 bmse011683 1 10 bmse011683 1 11 bmse011683 1 12 bmse011683 1 13 bmse011683 1 14 bmse011683 1 15 bmse011683 1 16 bmse011683 1 17 bmse011683 1 18 bmse011683 1 19 bmse011683 1 20 bmse011683 1 21 bmse011683 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 3.9503 bmse011683 1 2 1 6.9689 bmse011683 1 3 1 6.9633 bmse011683 1 4 1 6.9605 bmse011683 1 5 1 6.9546 bmse011683 1 6 1 4.6500 bmse011683 1 7 1 6.6764 bmse011683 1 8 1 6.6473 bmse011683 1 9 1 7.4603 bmse011683 1 10 1 7.4640 bmse011683 1 11 1 7.3096 bmse011683 1 12 1 7.3078 bmse011683 1 13 1 7.3012 bmse011683 1 14 1 7.2993 bmse011683 1 15 1 2.5967 bmse011683 1 16 1 2.5998 bmse011683 1 17 1 2.6029 bmse011683 1 18 1 2.6060 bmse011683 1 19 1 2.6091 bmse011683 1 20 1 7.0217 bmse011683 1 21 1 7.0265 bmse011683 1 stop_ save_