######################### # 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 bmse011273 _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 bmse011273 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 bmse011273 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011273 1 2 bmse011273 1 3 bmse011273 1 4 bmse011273 1 5 bmse011273 1 6 bmse011273 1 7 bmse011273 1 8 bmse011273 1 9 bmse011273 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 7.4897 m_2H bmse011273 1 2 1 8.0056 s_1H bmse011273 1 3 1 2.4848 Imp1 bmse011273 1 4 1 1.0926 m_1H bmse011273 1 5 1 6.4371 m_1H bmse011273 1 6 1 8.3393 s_1H_Q1 bmse011273 1 7 1 2.6028 DMSO bmse011273 1 8 1 7.3837 m_2H bmse011273 1 9 1 2.7127 Imp2 bmse011273 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 8.2530 bmse011273 1 2 2 1 0.0000 bmse011273 1 3 3 1 0.0000 bmse011273 1 4 4 1 7.0975 bmse011273 1 5 5 1 5.6854 bmse011273 1 6 6 1 0.0000 bmse011273 1 7 7 1 1.9532 bmse011273 1 8 8 1 2.7070 bmse011273 1 9 9 1 0.0000 bmse011273 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011273 1 2 bmse011273 1 3 bmse011273 1 4 bmse011273 1 5 bmse011273 1 6 bmse011273 1 7 bmse011273 1 8 bmse011273 1 9 bmse011273 1 10 bmse011273 1 11 bmse011273 1 12 bmse011273 1 13 bmse011273 1 14 bmse011273 1 15 bmse011273 1 16 bmse011273 1 17 bmse011273 1 18 bmse011273 1 19 bmse011273 1 20 bmse011273 1 21 bmse011273 1 22 bmse011273 1 23 bmse011273 1 24 bmse011273 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 7.4966 bmse011273 1 2 1 7.4829 bmse011273 1 3 1 8.0056 bmse011273 1 4 1 2.4848 bmse011273 1 5 1 1.1044 bmse011273 1 6 1 1.0927 bmse011273 1 7 1 1.0807 bmse011273 1 8 1 6.4513 bmse011273 1 9 1 6.4440 bmse011273 1 10 1 6.4356 bmse011273 1 11 1 6.4229 bmse011273 1 12 1 8.3393 bmse011273 1 13 1 2.5963 bmse011273 1 14 1 2.5998 bmse011273 1 15 1 2.6029 bmse011273 1 16 1 2.6058 bmse011273 1 17 1 2.6093 bmse011273 1 18 1 7.3725 bmse011273 1 19 1 7.3767 bmse011273 1 20 1 7.3800 bmse011273 1 21 1 7.3871 bmse011273 1 22 1 7.3906 bmse011273 1 23 1 7.3950 bmse011273 1 24 1 2.7127 bmse011273 1 stop_ save_