######################### # 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 bmse011184 _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 bmse011184 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 bmse011184 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011184 1 2 bmse011184 1 3 bmse011184 1 4 bmse011184 1 5 bmse011184 1 6 bmse011184 1 7 bmse011184 1 8 bmse011184 1 9 bmse011184 1 10 bmse011184 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 4.6500 SUP bmse011184 1 2 1 2.3276 t_2H bmse011184 1 3 1 6.2130 s_1H bmse011184 1 4 1 1.9395 quint_2H bmse011184 1 5 1 3.3151 d_4H bmse011184 1 6 1 7.1945 m_2H_Q1 bmse011184 1 7 1 3.4603 t_2H bmse011184 1 8 1 2.6029 DMSO bmse011184 1 9 1 7.0978 t_1H bmse011184 1 10 1 7.3047 t_2H bmse011184 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 bmse011184 1 2 2 1 8.1979 bmse011184 1 3 3 1 0.0000 bmse011184 1 4 4 1 7.6752 bmse011184 1 5 5 1 2.7510 bmse011184 1 6 6 1 7.7028 bmse011184 1 7 7 1 7.2076 bmse011184 1 8 8 1 0.0000 bmse011184 1 9 9 1 7.2626 bmse011184 1 10 10 1 7.7578 bmse011184 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011184 1 2 bmse011184 1 3 bmse011184 1 4 bmse011184 1 5 bmse011184 1 6 bmse011184 1 7 bmse011184 1 8 bmse011184 1 9 bmse011184 1 10 bmse011184 1 11 bmse011184 1 12 bmse011184 1 13 bmse011184 1 14 bmse011184 1 15 bmse011184 1 16 bmse011184 1 17 bmse011184 1 18 bmse011184 1 19 bmse011184 1 20 bmse011184 1 21 bmse011184 1 22 bmse011184 1 23 bmse011184 1 24 bmse011184 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 4.6500 bmse011184 1 2 1 2.3139 bmse011184 1 3 1 2.3277 bmse011184 1 4 1 2.3413 bmse011184 1 5 1 6.2130 bmse011184 1 6 1 1.9139 bmse011184 1 7 1 1.9269 bmse011184 1 8 1 1.9397 bmse011184 1 9 1 1.9524 bmse011184 1 10 1 1.9650 bmse011184 1 11 1 3.3128 bmse011184 1 12 1 3.3174 bmse011184 1 13 1 7.1880 bmse011184 1 14 1 7.2009 bmse011184 1 15 1 3.4483 bmse011184 1 16 1 3.4604 bmse011184 1 17 1 3.4723 bmse011184 1 18 1 2.6029 bmse011184 1 19 1 7.0857 bmse011184 1 20 1 7.0976 bmse011184 1 21 1 7.1099 bmse011184 1 22 1 7.2918 bmse011184 1 23 1 7.3048 bmse011184 1 24 1 7.3177 bmse011184 1 stop_ save_