######################### # 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 bmse011646 _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 bmse011646 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 bmse011646 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011646 1 2 bmse011646 1 4 bmse011646 1 6 bmse011646 1 7 bmse011646 1 8 bmse011646 1 9 bmse011646 1 10 bmse011646 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 2.6026 DMSO bmse011646 1 2 1 7.2143 dd_1H bmse011646 1 3 1 7.8706 dd_1H bmse011646 1 4 1 2.4848 Imp1 bmse011646 1 5 1 3.3441 t_6H bmse011646 1 6 1 7.7935 d_1H bmse011646 1 7 1 1.5670 m_9H_Q1 bmse011646 1 8 1 2.7160 Imp2 bmse011646 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 1.9532 bmse011646 1 2 2 1 4.8968 bmse011646 1 3 2 1 3.9064 bmse011646 1 4 3 1 3.7413 bmse011646 1 5 3 1 0.8803 bmse011646 1 6 4 1 0.0000 bmse011646 1 7 5 1 5.0068 bmse011646 1 8 6 1 4.9518 bmse011646 1 9 7 1 0.0000 bmse011646 1 10 8 1 0.0000 bmse011646 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011646 1 2 bmse011646 1 3 bmse011646 1 4 bmse011646 1 5 bmse011646 1 6 bmse011646 1 7 bmse011646 1 8 bmse011646 1 9 bmse011646 1 10 bmse011646 1 11 bmse011646 1 12 bmse011646 1 13 bmse011646 1 14 bmse011646 1 15 bmse011646 1 16 bmse011646 1 17 bmse011646 1 18 bmse011646 1 19 bmse011646 1 20 bmse011646 1 21 bmse011646 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 2.5961 bmse011646 1 2 1 2.5996 bmse011646 1 3 1 2.6027 bmse011646 1 4 1 2.6056 bmse011646 1 5 1 2.6091 bmse011646 1 6 1 7.2216 bmse011646 1 7 1 7.2152 bmse011646 1 8 1 7.2135 bmse011646 1 9 1 7.2069 bmse011646 1 10 1 7.8745 bmse011646 1 11 1 7.8730 bmse011646 1 12 1 7.8683 bmse011646 1 13 1 7.8668 bmse011646 1 14 1 2.4848 bmse011646 1 15 1 3.3357 bmse011646 1 16 1 3.3432 bmse011646 1 17 1 3.3524 bmse011646 1 18 1 7.7894 bmse011646 1 19 1 7.7977 bmse011646 1 20 1 1.5670 bmse011646 1 21 1 2.7160 bmse011646 1 stop_ save_