######################### # 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 bmse011395 _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 bmse011395 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 bmse011395 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011395 1 3 bmse011395 1 4 bmse011395 1 5 bmse011395 1 6 bmse011395 1 7 bmse011395 1 8 bmse011395 1 9 bmse011395 1 10 bmse011395 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 7.8880 dd_2H bmse011395 1 2 1 7.1294 m_3H bmse011395 1 3 1 2.6030 DMSO bmse011395 1 4 1 7.2272 m_2H_Q1 bmse011395 1 5 1 3.9147 m_6H bmse011395 1 6 1 7.5976 m_2H bmse011395 1 7 1 2.7195 Imp2 bmse011395 1 8 1 3.8951 m_1H bmse011395 1 9 1 8.8781 s_1H bmse011395 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 7.7578 bmse011395 1 2 1 1 1.5956 bmse011395 1 3 2 1 7.5927 bmse011395 1 4 3 1 1.9532 bmse011395 1 5 4 1 8.4730 bmse011395 1 6 5 1 0.0000 bmse011395 1 7 6 1 4.4016 bmse011395 1 8 7 1 0.0000 bmse011395 1 9 8 1 0.0000 bmse011395 1 10 9 1 0.0000 bmse011395 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011395 1 2 bmse011395 1 3 bmse011395 1 4 bmse011395 1 5 bmse011395 1 6 bmse011395 1 7 bmse011395 1 8 bmse011395 1 9 bmse011395 1 10 bmse011395 1 11 bmse011395 1 12 bmse011395 1 13 bmse011395 1 14 bmse011395 1 15 bmse011395 1 16 bmse011395 1 17 bmse011395 1 18 bmse011395 1 19 bmse011395 1 20 bmse011395 1 21 bmse011395 1 22 bmse011395 1 23 bmse011395 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 7.8958 bmse011395 1 2 1 7.8932 bmse011395 1 3 1 7.8829 bmse011395 1 4 1 7.8802 bmse011395 1 5 1 7.1420 bmse011395 1 6 1 7.1294 bmse011395 1 7 1 7.1167 bmse011395 1 8 1 2.5965 bmse011395 1 9 1 2.6001 bmse011395 1 10 1 2.6031 bmse011395 1 11 1 2.6060 bmse011395 1 12 1 2.6095 bmse011395 1 13 1 7.2201 bmse011395 1 14 1 7.2342 bmse011395 1 15 1 3.9147 bmse011395 1 16 1 7.6123 bmse011395 1 17 1 7.6095 bmse011395 1 18 1 7.5976 bmse011395 1 19 1 7.5857 bmse011395 1 20 1 7.5830 bmse011395 1 21 1 2.7195 bmse011395 1 22 1 3.8951 bmse011395 1 23 1 8.8781 bmse011395 1 stop_ save_