######################### # 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 bmse011611 _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 bmse011611 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 bmse011611 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011611 1 2 bmse011611 1 3 bmse011611 1 4 bmse011611 1 5 bmse011611 1 6 bmse011611 1 7 bmse011611 1 8 bmse011611 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 bmse011611 1 2 1 2.1745 quint_2H_Q1 bmse011611 1 3 1 3.5699 m_1H bmse011611 1 4 1 3.4036 m_2H bmse011611 1 5 1 2.2885 s_3H bmse011611 1 6 1 3.8773 s_1H bmse011611 1 7 1 2.6027 DMSO bmse011611 1 8 1 3.3071 m_2H bmse011611 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 bmse011611 1 2 2 1 5.6945 bmse011611 1 3 3 1 8.0549 bmse011611 1 4 4 1 5.1718 bmse011611 1 5 5 1 0.0000 bmse011611 1 6 6 1 0.0000 bmse011611 1 7 7 1 0.0000 bmse011611 1 8 8 1 5.3919 bmse011611 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011611 1 2 bmse011611 1 3 bmse011611 1 4 bmse011611 1 5 bmse011611 1 6 bmse011611 1 7 bmse011611 1 8 bmse011611 1 9 bmse011611 1 10 bmse011611 1 11 bmse011611 1 12 bmse011611 1 13 bmse011611 1 14 bmse011611 1 15 bmse011611 1 16 bmse011611 1 17 bmse011611 1 18 bmse011611 1 19 bmse011611 1 20 bmse011611 1 21 bmse011611 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 bmse011611 1 2 1 2.1555 bmse011611 1 3 1 2.1654 bmse011611 1 4 1 2.1744 bmse011611 1 5 1 2.1834 bmse011611 1 6 1 2.1935 bmse011611 1 7 1 3.6034 bmse011611 1 8 1 3.5711 bmse011611 1 9 1 3.5623 bmse011611 1 10 1 3.5513 bmse011611 1 11 1 3.5391 bmse011611 1 12 1 3.5363 bmse011611 1 13 1 3.4122 bmse011611 1 14 1 3.4036 bmse011611 1 15 1 3.3950 bmse011611 1 16 1 2.2885 bmse011611 1 17 1 3.8773 bmse011611 1 18 1 2.6027 bmse011611 1 19 1 3.3161 bmse011611 1 20 1 3.3071 bmse011611 1 21 1 3.2981 bmse011611 1 stop_ save_