######################### # 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 bmse011420 _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 bmse011420 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 bmse011420 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011420 1 2 bmse011420 1 3 bmse011420 1 4 bmse011420 1 5 bmse011420 1 6 bmse011420 1 7 bmse011420 1 8 bmse011420 1 9 bmse011420 1 10 bmse011420 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 1.9098 m_3H bmse011420 1 2 1 6.9766 s_2H bmse011420 1 3 1 2.4852 Imp1 bmse011420 1 4 1 2.1019 m_12H bmse011420 1 5 1 2.6031 DMSO bmse011420 1 6 1 1.7377 m_3H_Q1 bmse011420 1 7 1 2.7201 Imp2 bmse011420 1 8 1 2.2830 m_9H bmse011420 1 9 1 3.1542 quint_3H bmse011420 1 10 1 8.4196 s_2H bmse011420 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 5.1963 bmse011420 1 2 2 1 0.0000 bmse011420 1 3 3 1 0.0000 bmse011420 1 4 4 1 4.3741 bmse011420 1 5 5 1 1.8707 bmse011420 1 6 6 1 4.0348 bmse011420 1 7 7 1 0.0000 bmse011420 1 8 8 1 0.0000 bmse011420 1 9 9 1 8.8582 bmse011420 1 10 10 1 0.0000 bmse011420 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011420 1 2 bmse011420 1 3 bmse011420 1 4 bmse011420 1 5 bmse011420 1 6 bmse011420 1 7 bmse011420 1 8 bmse011420 1 9 bmse011420 1 10 bmse011420 1 11 bmse011420 1 12 bmse011420 1 13 bmse011420 1 14 bmse011420 1 15 bmse011420 1 16 bmse011420 1 17 bmse011420 1 18 bmse011420 1 19 bmse011420 1 20 bmse011420 1 21 bmse011420 1 22 bmse011420 1 23 bmse011420 1 24 bmse011420 1 25 bmse011420 1 26 bmse011420 1 27 bmse011420 1 28 bmse011420 1 29 bmse011420 1 30 bmse011420 1 31 bmse011420 1 32 bmse011420 1 33 bmse011420 1 34 bmse011420 1 35 bmse011420 1 36 bmse011420 1 37 bmse011420 1 38 bmse011420 1 39 bmse011420 1 40 bmse011420 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 1.9487 bmse011420 1 2 1 1.9342 bmse011420 1 3 1 1.9307 bmse011420 1 4 1 1.9186 bmse011420 1 5 1 1.9161 bmse011420 1 6 1 1.9133 bmse011420 1 7 1 1.9043 bmse011420 1 8 1 1.9005 bmse011420 1 9 1 1.8864 bmse011420 1 10 1 1.8708 bmse011420 1 11 1 6.9766 bmse011420 1 12 1 2.4852 bmse011420 1 13 1 2.1165 bmse011420 1 14 1 2.1124 bmse011420 1 15 1 2.1020 bmse011420 1 16 1 2.0980 bmse011420 1 17 1 2.0873 bmse011420 1 18 1 2.5968 bmse011420 1 19 1 2.5998 bmse011420 1 20 1 2.6029 bmse011420 1 21 1 2.6060 bmse011420 1 22 1 2.6093 bmse011420 1 23 1 1.7679 bmse011420 1 24 1 1.7577 bmse011420 1 25 1 1.7498 bmse011420 1 26 1 1.7457 bmse011420 1 27 1 1.7386 bmse011420 1 28 1 1.7336 bmse011420 1 29 1 1.7269 bmse011420 1 30 1 1.7199 bmse011420 1 31 1 1.7153 bmse011420 1 32 1 1.7074 bmse011420 1 33 1 2.7201 bmse011420 1 34 1 2.2830 bmse011420 1 35 1 3.1247 bmse011420 1 36 1 3.1399 bmse011420 1 37 1 3.1544 bmse011420 1 38 1 3.1691 bmse011420 1 39 1 3.1837 bmse011420 1 40 1 8.4196 bmse011420 1 stop_ save_