######################### # 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 bmse011017 _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 bmse011017 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 bmse011017 1 stop_ loop_ _Peak.ID _Peak.Entry_ID _Peak.Spectral_peak_list_ID 1 bmse011017 1 2 bmse011017 1 3 bmse011017 1 4 bmse011017 1 5 bmse011017 1 6 bmse011017 1 7 bmse011017 1 8 bmse011017 1 9 bmse011017 1 10 bmse011017 1 11 bmse011017 1 12 bmse011017 1 13 bmse011017 1 14 bmse011017 1 15 bmse011017 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 2.6031 DMSO bmse011017 1 2 1 3.5679 q_2H bmse011017 1 3 1 1.0906 m_3H bmse011017 1 4 1 3.5123 s_3H bmse011017 1 5 1 7.7640 m_4H bmse011017 1 6 1 1.2510 m_15H bmse011017 1 7 1 7.8406 m_4H bmse011017 1 8 1 3.1098 t_2H bmse011017 1 9 1 8.6009 m_1H bmse011017 1 10 1 8.7571 m_3H_Q1 bmse011017 1 11 1 3.2694 s_2H bmse011017 1 12 1 6.5718 s_1H bmse011017 1 13 1 7.5921 m_2H bmse011017 1 14 1 9.2300 s_1H bmse011017 1 15 1 3.6294 m_2H bmse011017 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 bmse011017 1 2 2 1 7.0058 bmse011017 1 3 3 1 4.0715 bmse011017 1 4 4 1 0.0000 bmse011017 1 5 5 1 8.4730 bmse011017 1 6 6 1 5.7771 bmse011017 1 7 7 1 8.5831 bmse011017 1 8 8 1 7.4277 bmse011017 1 9 9 1 8.5831 bmse011017 1 10 10 1 12.1043 bmse011017 1 11 11 1 0.0000 bmse011017 1 12 12 1 0.0000 bmse011017 1 13 13 1 3.0811 bmse011017 1 14 14 1 0.0000 bmse011017 1 15 15 1 4.4383 bmse011017 1 stop_ loop_ _Spectral_transition.ID _Spectral_transition.Entry_ID _Spectral_transition.Spectral_peak_list_ID 1 bmse011017 1 2 bmse011017 1 3 bmse011017 1 4 bmse011017 1 5 bmse011017 1 6 bmse011017 1 7 bmse011017 1 8 bmse011017 1 9 bmse011017 1 10 bmse011017 1 11 bmse011017 1 12 bmse011017 1 13 bmse011017 1 14 bmse011017 1 15 bmse011017 1 16 bmse011017 1 17 bmse011017 1 18 bmse011017 1 19 bmse011017 1 20 bmse011017 1 21 bmse011017 1 22 bmse011017 1 23 bmse011017 1 24 bmse011017 1 25 bmse011017 1 26 bmse011017 1 27 bmse011017 1 28 bmse011017 1 29 bmse011017 1 30 bmse011017 1 31 bmse011017 1 32 bmse011017 1 33 bmse011017 1 34 bmse011017 1 35 bmse011017 1 36 bmse011017 1 37 bmse011017 1 38 bmse011017 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 2.6031 bmse011017 1 2 1 3.5504 bmse011017 1 3 1 3.5618 bmse011017 1 4 1 3.5737 bmse011017 1 5 1 3.5855 bmse011017 1 6 1 1.1042 bmse011017 1 7 1 1.0925 bmse011017 1 8 1 1.0877 bmse011017 1 9 1 1.0806 bmse011017 1 10 1 1.0771 bmse011017 1 11 1 3.5123 bmse011017 1 12 1 7.7570 bmse011017 1 13 1 7.7711 bmse011017 1 14 1 1.2606 bmse011017 1 15 1 1.2494 bmse011017 1 16 1 1.2414 bmse011017 1 17 1 7.8477 bmse011017 1 18 1 7.8334 bmse011017 1 19 1 3.0974 bmse011017 1 20 1 3.1098 bmse011017 1 21 1 3.1221 bmse011017 1 22 1 8.5938 bmse011017 1 23 1 8.6081 bmse011017 1 24 1 8.7773 bmse011017 1 25 1 8.7733 bmse011017 1 26 1 8.7370 bmse011017 1 27 1 3.2694 bmse011017 1 28 1 6.5718 bmse011017 1 29 1 7.6024 bmse011017 1 30 1 7.5996 bmse011017 1 31 1 7.5930 bmse011017 1 32 1 7.5897 bmse011017 1 33 1 7.5819 bmse011017 1 34 1 9.2300 bmse011017 1 35 1 3.6405 bmse011017 1 36 1 3.6291 bmse011017 1 37 1 3.6230 bmse011017 1 38 1 3.6183 bmse011017 1 stop_ save_