######################### # 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 bmse011490 _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 bmse011490 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 bmse011490 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011490 1 2 bmse011490 1 3 bmse011490 1 4 bmse011490 1 5 bmse011490 1 6 bmse011490 1 7 bmse011490 1 8 bmse011490 1 9 bmse011490 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 1.2547 m_1H bmse011490 1 2 1 4.6500 SUP bmse011490 1 3 1 2.4852 Imp1 bmse011490 1 4 1 2.7173 Imp2 bmse011490 1 5 1 0.8953 m_2H bmse011490 1 6 1 1.0624 m_2H bmse011490 1 7 1 3.8064 s_2H bmse011490 1 8 1 3.6648 m_4H bmse011490 1 9 1 2.6029 DMSO bmse011490 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 4.2549 bmse011490 1 2 2 1 0.0000 bmse011490 1 3 3 1 0.0000 bmse011490 1 4 4 1 0.0000 bmse011490 1 5 5 1 3.2352 bmse011490 1 6 6 1 3.9174 bmse011490 1 7 7 1 0.0000 bmse011490 1 8 8 1 8.5831 bmse011490 1 9 9 1 0.0000 bmse011490 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011490 1 2 bmse011490 1 3 bmse011490 1 4 bmse011490 1 5 bmse011490 1 6 bmse011490 1 7 bmse011490 1 8 bmse011490 1 9 bmse011490 1 10 bmse011490 1 11 bmse011490 1 12 bmse011490 1 13 bmse011490 1 14 bmse011490 1 15 bmse011490 1 16 bmse011490 1 17 bmse011490 1 18 bmse011490 1 19 bmse011490 1 20 bmse011490 1 21 bmse011490 1 22 bmse011490 1 23 bmse011490 1 24 bmse011490 1 25 bmse011490 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 1.2654 bmse011490 1 2 1 1.2606 bmse011490 1 3 1 1.2494 bmse011490 1 4 1 1.2441 bmse011490 1 5 1 4.6500 bmse011490 1 6 1 2.4852 bmse011490 1 7 1 2.7173 bmse011490 1 8 1 0.9088 bmse011490 1 9 1 0.9014 bmse011490 1 10 1 0.8978 bmse011490 1 11 1 0.8936 bmse011490 1 12 1 0.8897 bmse011490 1 13 1 0.8818 bmse011490 1 14 1 1.0787 bmse011490 1 15 1 1.0712 bmse011490 1 16 1 1.0670 bmse011490 1 17 1 1.0569 bmse011490 1 18 1 1.0531 bmse011490 1 19 1 1.0461 bmse011490 1 20 1 3.8064 bmse011490 1 21 1 3.6863 bmse011490 1 22 1 3.6786 bmse011490 1 23 1 3.6707 bmse011490 1 24 1 3.6434 bmse011490 1 25 1 2.6029 bmse011490 1 stop_ save_