######################### # 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 bmse011739 _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 bmse011739 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 bmse011739 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011739 1 2 bmse011739 1 3 bmse011739 1 4 bmse011739 1 5 bmse011739 1 6 bmse011739 1 7 bmse011739 1 8 bmse011739 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 bmse011739 1 2 1 7.4334 m_2H bmse011739 1 3 1 4.0102 m_2H_Q1 bmse011739 1 4 1 1.6715 m_3H bmse011739 1 5 1 2.6028 DMSO bmse011739 1 6 1 2.0703 m_3H bmse011739 1 7 1 3.4318 m_4H bmse011739 1 8 1 7.1945 m_2H bmse011739 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 bmse011739 1 2 2 1 5.6395 bmse011739 1 3 3 1 5.5386 bmse011739 1 4 4 1 6.0050 bmse011739 1 5 5 1 1.9532 bmse011739 1 6 6 1 4.9885 bmse011739 1 7 7 1 6.0742 bmse011739 1 8 8 1 7.3286 bmse011739 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011739 1 2 bmse011739 1 3 bmse011739 1 4 bmse011739 1 5 bmse011739 1 6 bmse011739 1 7 bmse011739 1 8 bmse011739 1 9 bmse011739 1 10 bmse011739 1 11 bmse011739 1 12 bmse011739 1 13 bmse011739 1 14 bmse011739 1 15 bmse011739 1 16 bmse011739 1 17 bmse011739 1 18 bmse011739 1 19 bmse011739 1 20 bmse011739 1 21 bmse011739 1 22 bmse011739 1 23 bmse011739 1 24 bmse011739 1 25 bmse011739 1 26 bmse011739 1 27 bmse011739 1 28 bmse011739 1 29 bmse011739 1 30 bmse011739 1 31 bmse011739 1 32 bmse011739 1 33 bmse011739 1 34 bmse011739 1 35 bmse011739 1 36 bmse011739 1 37 bmse011739 1 38 bmse011739 1 39 bmse011739 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 bmse011739 1 2 1 7.4522 bmse011739 1 3 1 7.4497 bmse011739 1 4 1 7.4396 bmse011739 1 5 1 7.4271 bmse011739 1 6 1 7.4147 bmse011739 1 7 1 4.0240 bmse011739 1 8 1 4.0158 bmse011739 1 9 1 4.0038 bmse011739 1 10 1 3.9963 bmse011739 1 11 1 1.7065 bmse011739 1 12 1 1.6984 bmse011739 1 13 1 1.6858 bmse011739 1 14 1 1.6779 bmse011739 1 15 1 1.6649 bmse011739 1 16 1 1.6574 bmse011739 1 17 1 1.6445 bmse011739 1 18 1 1.6365 bmse011739 1 19 1 2.5963 bmse011739 1 20 1 2.5998 bmse011739 1 21 1 2.6029 bmse011739 1 22 1 2.6058 bmse011739 1 23 1 2.6093 bmse011739 1 24 1 2.0827 bmse011739 1 25 1 2.0791 bmse011739 1 26 1 2.0617 bmse011739 1 27 1 2.0578 bmse011739 1 28 1 3.4571 bmse011739 1 29 1 3.4500 bmse011739 1 30 1 3.4298 bmse011739 1 31 1 3.4270 bmse011739 1 32 1 3.4093 bmse011739 1 33 1 3.4065 bmse011739 1 34 1 7.2251 bmse011739 1 35 1 7.2126 bmse011739 1 36 1 7.2011 bmse011739 1 37 1 7.1952 bmse011739 1 38 1 7.1785 bmse011739 1 39 1 7.1640 bmse011739 1 stop_ save_