######################### # 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 bmse011736 _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 bmse011736 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 bmse011736 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011736 1 2 bmse011736 1 3 bmse011736 1 4 bmse011736 1 6 bmse011736 1 7 bmse011736 1 8 bmse011736 1 9 bmse011736 1 10 bmse011736 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 3.1685 3,5_m bmse011736 1 2 1 4.6500 SUP bmse011736 1 3 1 3.5019 3_m bmse011736 1 4 1 3.5855 4_dd bmse011736 1 5 1 7.4059 11,12,13,14, bmse011736 1 6 1 2.6363 DMSO_5,7_m bmse011736 1 7 1 4.0512 6,10_m_Q3 bmse011736 1 8 1 2.8408 7_m_Q1 bmse011736 1 9 1 3.7154 6,10_m_Q2 bmse011736 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 76.7699 bmse011736 1 2 2 1 0.0000 bmse011736 1 3 3 1 5.9788 bmse011736 1 4 4 1 12.2144 bmse011736 1 5 4 1 3.3012 bmse011736 1 6 5 1 57.3747 bmse011736 1 7 6 1 79.3815 bmse011736 1 8 7 1 88.8800 bmse011736 1 9 8 1 5.7441 bmse011736 1 10 9 1 74.1632 bmse011736 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011736 1 2 bmse011736 1 3 bmse011736 1 4 bmse011736 1 5 bmse011736 1 6 bmse011736 1 7 bmse011736 1 8 bmse011736 1 9 bmse011736 1 10 bmse011736 1 11 bmse011736 1 12 bmse011736 1 13 bmse011736 1 14 bmse011736 1 15 bmse011736 1 16 bmse011736 1 17 bmse011736 1 18 bmse011736 1 19 bmse011736 1 20 bmse011736 1 21 bmse011736 1 22 bmse011736 1 23 bmse011736 1 24 bmse011736 1 25 bmse011736 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 3.2325 bmse011736 1 2 1 3.1046 bmse011736 1 3 1 4.6500 bmse011736 1 4 1 3.5169 bmse011736 1 5 1 3.5073 bmse011736 1 6 1 3.4963 bmse011736 1 7 1 3.4870 bmse011736 1 8 1 3.5985 bmse011736 1 9 1 3.5930 bmse011736 1 10 1 3.5781 bmse011736 1 11 1 3.5726 bmse011736 1 12 1 7.4537 bmse011736 1 13 1 7.3581 bmse011736 1 14 1 2.7024 bmse011736 1 15 1 2.5701 bmse011736 1 16 1 4.1252 bmse011736 1 17 1 3.9771 bmse011736 1 18 1 2.8647 bmse011736 1 19 1 2.8583 bmse011736 1 20 1 2.8440 bmse011736 1 21 1 2.8378 bmse011736 1 22 1 2.8233 bmse011736 1 23 1 2.8169 bmse011736 1 24 1 3.7772 bmse011736 1 25 1 3.6536 bmse011736 1 stop_ save_