######################### # 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 bmse011570 _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 bmse011570 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 bmse011570 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011570 1 2 bmse011570 1 3 bmse011570 1 4 bmse011570 1 5 bmse011570 1 6 bmse011570 1 7 bmse011570 1 8 bmse011570 1 9 bmse011570 1 10 bmse011570 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 7.4350 3_s bmse011570 1 2 1 1.9837 15_m bmse011570 1 3 1 1.8547 14,15_m bmse011570 1 4 1 3.4137 10_m bmse011570 1 5 1 4.6500 SUP bmse011570 1 6 1 3.7973 13_m bmse011570 1 7 1 2.5387 12_s_Q2 bmse011570 1 8 1 1.5878 14_m_Q1 bmse011570 1 9 1 3.7066 13_m_Q3 bmse011570 1 10 1 2.6030 DMSO bmse011570 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 bmse011570 1 2 2 1 3.0411 bmse011570 1 3 3 1 78.2359 bmse011570 1 4 4 1 5.9971 bmse011570 1 5 5 1 0.0000 bmse011570 1 6 6 1 7.3726 bmse011570 1 7 7 1 0.0000 bmse011570 1 8 8 1 3.5103 bmse011570 1 9 9 1 5.4745 bmse011570 1 10 10 1 1.8432 bmse011570 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011570 1 2 bmse011570 1 3 bmse011570 1 4 bmse011570 1 5 bmse011570 1 6 bmse011570 1 7 bmse011570 1 8 bmse011570 1 9 bmse011570 1 10 bmse011570 1 11 bmse011570 1 12 bmse011570 1 13 bmse011570 1 14 bmse011570 1 15 bmse011570 1 16 bmse011570 1 17 bmse011570 1 18 bmse011570 1 19 bmse011570 1 20 bmse011570 1 21 bmse011570 1 22 bmse011570 1 23 bmse011570 1 24 bmse011570 1 25 bmse011570 1 26 bmse011570 1 27 bmse011570 1 28 bmse011570 1 29 bmse011570 1 30 bmse011570 1 31 bmse011570 1 32 bmse011570 1 33 bmse011570 1 34 bmse011570 1 35 bmse011570 1 36 bmse011570 1 37 bmse011570 1 38 bmse011570 1 39 bmse011570 1 40 bmse011570 1 41 bmse011570 1 42 bmse011570 1 43 bmse011570 1 44 bmse011570 1 45 bmse011570 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 7.4350 bmse011570 1 2 1 2.0116 bmse011570 1 3 1 2.0021 bmse011570 1 4 1 1.9993 bmse011570 1 5 1 1.9903 bmse011570 1 6 1 1.9863 bmse011570 1 7 1 1.9813 bmse011570 1 8 1 1.9769 bmse011570 1 9 1 1.9700 bmse011570 1 10 1 1.9676 bmse011570 1 11 1 1.9652 bmse011570 1 12 1 1.9648 bmse011570 1 13 1 1.9559 bmse011570 1 14 1 1.9199 bmse011570 1 15 1 1.7895 bmse011570 1 16 1 3.4237 bmse011570 1 17 1 3.4138 bmse011570 1 18 1 3.4038 bmse011570 1 19 1 4.6500 bmse011570 1 20 1 3.8157 bmse011570 1 21 1 3.8038 bmse011570 1 22 1 3.7904 bmse011570 1 23 1 3.7789 bmse011570 1 24 1 2.5387 bmse011570 1 25 1 1.6170 bmse011570 1 26 1 1.6051 bmse011570 1 27 1 1.6026 bmse011570 1 28 1 1.5960 bmse011570 1 29 1 1.5956 bmse011570 1 30 1 1.5932 bmse011570 1 31 1 1.5914 bmse011570 1 32 1 1.5842 bmse011570 1 33 1 1.5793 bmse011570 1 34 1 1.5705 bmse011570 1 35 1 1.5585 bmse011570 1 36 1 3.7248 bmse011570 1 37 1 3.7120 bmse011570 1 38 1 3.7017 bmse011570 1 39 1 3.6988 bmse011570 1 40 1 3.6883 bmse011570 1 41 1 2.5968 bmse011570 1 42 1 2.5998 bmse011570 1 43 1 2.6029 bmse011570 1 44 1 2.6060 bmse011570 1 45 1 2.6091 bmse011570 1 stop_ save_