######################### # 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 bmse011566 _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 bmse011566 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 bmse011566 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011566 1 2 bmse011566 1 3 bmse011566 1 4 bmse011566 1 5 bmse011566 1 6 bmse011566 1 7 bmse011566 1 8 bmse011566 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 3.4235 5_m_Q3 bmse011566 1 2 1 0.8111 11_m bmse011566 1 3 1 1.1162 10_m_Q1 bmse011566 1 4 1 1.3599 10_m_Q2 bmse011566 1 5 1 1.5674 9_m bmse011566 1 6 1 4.6500 SUP bmse011566 1 7 1 1.7277 7_m bmse011566 1 8 1 2.6344 DMSO_5_m bmse011566 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 4.7179 bmse011566 1 2 2 1 3.1911 bmse011566 1 3 3 1 3.0732 bmse011566 1 4 4 1 4.4676 bmse011566 1 5 5 1 141.6289 bmse011566 1 6 6 1 0.0000 bmse011566 1 7 7 1 4.2640 bmse011566 1 8 8 1 77.4281 bmse011566 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011566 1 2 bmse011566 1 3 bmse011566 1 4 bmse011566 1 5 bmse011566 1 6 bmse011566 1 7 bmse011566 1 8 bmse011566 1 9 bmse011566 1 10 bmse011566 1 11 bmse011566 1 12 bmse011566 1 13 bmse011566 1 14 bmse011566 1 15 bmse011566 1 16 bmse011566 1 17 bmse011566 1 18 bmse011566 1 19 bmse011566 1 20 bmse011566 1 21 bmse011566 1 22 bmse011566 1 23 bmse011566 1 24 bmse011566 1 25 bmse011566 1 26 bmse011566 1 27 bmse011566 1 28 bmse011566 1 29 bmse011566 1 30 bmse011566 1 31 bmse011566 1 32 bmse011566 1 33 bmse011566 1 34 bmse011566 1 35 bmse011566 1 36 bmse011566 1 37 bmse011566 1 38 bmse011566 1 39 bmse011566 1 40 bmse011566 1 41 bmse011566 1 42 bmse011566 1 43 bmse011566 1 44 bmse011566 1 45 bmse011566 1 46 bmse011566 1 47 bmse011566 1 48 bmse011566 1 49 bmse011566 1 50 bmse011566 1 51 bmse011566 1 52 bmse011566 1 53 bmse011566 1 54 bmse011566 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 3.4549 bmse011566 1 2 1 3.4485 bmse011566 1 3 1 3.4421 bmse011566 1 4 1 3.4320 bmse011566 1 5 1 3.4208 bmse011566 1 6 1 3.4138 bmse011566 1 7 1 3.3979 bmse011566 1 8 1 3.3953 bmse011566 1 9 1 3.3920 bmse011566 1 10 1 0.8191 bmse011566 1 11 1 0.8143 bmse011566 1 12 1 0.8079 bmse011566 1 13 1 0.8032 bmse011566 1 14 1 1.1521 bmse011566 1 15 1 1.1515 bmse011566 1 16 1 1.1457 bmse011566 1 17 1 1.1392 bmse011566 1 18 1 1.1339 bmse011566 1 19 1 1.1273 bmse011566 1 20 1 1.1233 bmse011566 1 21 1 1.1167 bmse011566 1 22 1 1.1116 bmse011566 1 23 1 1.1051 bmse011566 1 24 1 1.0991 bmse011566 1 25 1 1.0987 bmse011566 1 26 1 1.0930 bmse011566 1 27 1 1.0868 bmse011566 1 28 1 1.0804 bmse011566 1 29 1 1.4157 bmse011566 1 30 1 1.4089 bmse011566 1 31 1 1.3965 bmse011566 1 32 1 1.3895 bmse011566 1 33 1 1.3827 bmse011566 1 34 1 1.3778 bmse011566 1 35 1 1.3712 bmse011566 1 36 1 1.3673 bmse011566 1 37 1 1.3596 bmse011566 1 38 1 1.3527 bmse011566 1 39 1 1.3481 bmse011566 1 40 1 1.3407 bmse011566 1 41 1 1.3328 bmse011566 1 42 1 1.3303 bmse011566 1 43 1 1.3105 bmse011566 1 44 1 1.3041 bmse011566 1 45 1 1.6854 bmse011566 1 46 1 1.4494 bmse011566 1 47 1 4.6500 bmse011566 1 48 1 1.7419 bmse011566 1 49 1 1.7357 bmse011566 1 50 1 1.7283 bmse011566 1 51 1 1.7201 bmse011566 1 52 1 1.7135 bmse011566 1 53 1 2.6989 bmse011566 1 54 1 2.5699 bmse011566 1 stop_ save_