######################### # 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 bmse011255 _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 bmse011255 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 bmse011255 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011255 1 2 bmse011255 1 3 bmse011255 1 4 bmse011255 1 5 bmse011255 1 6 bmse011255 1 7 bmse011255 1 8 bmse011255 1 9 bmse011255 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 2.7166 Imp2 bmse011255 1 2 1 3.2699 s_1H bmse011255 1 3 1 8.8026 m_4H bmse011255 1 4 1 1.0910 m_3H bmse011255 1 5 1 3.5682 q_1H bmse011255 1 6 1 7.8501 s_1H bmse011255 1 7 1 2.6031 DMSO bmse011255 1 8 1 2.4883 Imp1 bmse011255 1 9 1 3.1603 m_6H_Q1 bmse011255 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 bmse011255 1 2 2 1 0.0000 bmse011255 1 3 3 1 0.0000 bmse011255 1 4 4 1 4.1265 bmse011255 1 5 5 1 7.1159 bmse011255 1 6 6 1 0.0000 bmse011255 1 7 7 1 1.9257 bmse011255 1 8 8 1 0.0000 bmse011255 1 9 9 1 6.9325 bmse011255 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011255 1 2 bmse011255 1 3 bmse011255 1 4 bmse011255 1 5 bmse011255 1 6 bmse011255 1 7 bmse011255 1 8 bmse011255 1 9 bmse011255 1 10 bmse011255 1 11 bmse011255 1 12 bmse011255 1 13 bmse011255 1 14 bmse011255 1 15 bmse011255 1 16 bmse011255 1 17 bmse011255 1 18 bmse011255 1 19 bmse011255 1 20 bmse011255 1 21 bmse011255 1 22 bmse011255 1 23 bmse011255 1 24 bmse011255 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 2.7166 bmse011255 1 2 1 3.2699 bmse011255 1 3 1 8.8026 bmse011255 1 4 1 1.1048 bmse011255 1 5 1 1.0928 bmse011255 1 6 1 1.0877 bmse011255 1 7 1 1.0809 bmse011255 1 8 1 1.0773 bmse011255 1 9 1 3.5504 bmse011255 1 10 1 3.5623 bmse011255 1 11 1 3.5743 bmse011255 1 12 1 3.5860 bmse011255 1 13 1 7.8501 bmse011255 1 14 1 2.5967 bmse011255 1 15 1 2.6001 bmse011255 1 16 1 2.6031 bmse011255 1 17 1 2.6062 bmse011255 1 18 1 2.6095 bmse011255 1 19 1 2.4883 bmse011255 1 20 1 3.1834 bmse011255 1 21 1 3.1718 bmse011255 1 22 1 3.1603 bmse011255 1 23 1 3.1487 bmse011255 1 24 1 3.1372 bmse011255 1 stop_ save_