; SRI experiment ; ; Selective fluorine reverse INEPT (19F-1H correlation) ; using selective 90 19F pulse for excitation ; using PFG for CTP selection ; ; Developed by: ; NMR Methodology Group ; University of Manchester ; ; L. Castaņar, P. Moutzouri, T. Barbosa, C. Tormena, R. Rittner, A. Phillips, S. Coombes, M. Nilsson, G. A. Morris. ; Anal. Chem., 2018, 90, 8, 5445-5450 ; DOI: 10.1021/acs.analchem.8b00753 ; ; ; Options: ; [cnst1 = 1] with 1H purge pulses before d1 ; [cnst1 = 0] without 1H purge pulses before d1 ;avance-version (2018/01/19) ; ;$CLASS=HighRes ;$DIM=1D ;$TYPE= ;$SUBTYPE= ;$COMMENT= #include #include #include "d2=1s/(4*cnst2)" "d13=20u" "d16=200u" "d26=p16+d16" "DELTA1=d2-larger(p2,p4)/2" "DELTA2=d2-p16-d16-larger(p2,p4)/2" "p2=p1*2" "p4=p3*2" "spoff11=0" "acqt0=0" baseopt_echo 1 ze 30m 2 30m d13 UNBLKGRAD if "cnst1 == 1" ;Purge pulses { d13 UNBLKGRAD d13 pl1:f1 p16:gp20 d16 (p1 ph20):f1 (p1 ph21):f1 p16:gp21 d16 d13 BLKGRAD } else { } d1 ;F - H AP transfer d13 UNBLKGRAD d13 pl0:f2 pl1:f1 (p11:sp11 ph1):f2 DELTA1 pl2:f2 (center (p2 ph2):f1 (p4 ph3):f2 ) DELTA2 p16:gp1 d16 (p3 ph4):f2 p16:gp2 d16 (p1 ph5):f1 d26 (p2 ph6):f1 p16:gp1*0.9407 d16 go=2 ph31 30m mc #0 to 2 F0(zd) d13 BLKGRAD exit ph1=0 2 2 0 ph2=0 ph3=0 ph4=1 ph5=0 ph6=0 ph20=0 ph21=1 ph31=0 2 2 0 ;POWER LEVEL ;pl0 : zero power (0 W) ;pl1 : f1 channel - power level for pulse (default) ;pl2 : f2 channel - power level for pulse (default) ;sp11 : f2 channel - power level of excitation shaped pulse ;PULSE DURATION ;p1 : f1 channel - 90 degree high power pulse ;p2 : f1 channel - 180 degree high power pulse ;p3 : f2 channel - 90 degree high power pulse ;p4 : f2 channel - 180 degree high power pulse ;p11: f2 channel - 90 degree low power shaped pulse ; choose p11 according to desired selectivity ;GRADIENT DURATION ;p16: duration of CTP gradients [1 ms] ;DELAY ;d1 : relaxation delay; 1-5 * T1 ;d2 : 1/(4*J(XH)) ;d16: delay for gradient recovery [200 usec] ;PULSE SHAPE ;spnam11 : f2 channel - file name for the selective 90 excitation shaped pulse [Gauss] ;GRADIENT SHAPE ;gpnam1 : SMSQ10.100 ;gpnam2 : SMSQ10.100 ;gpnam20: SMSQ10.100 ;gpnam21: SMSQ10.100 ;GRADIENT STRENGTH ;gpz1 : F-H CTP gradient [47%] ;gpz2 : homospoil gradient [37%] ;gpz20 : homospoil gradient purge pulses [53%] ;gpz21 : homospoil gradient purge pulses [59%] ;CONSTANTS ;cnst1 : 0 (--) / 1 (Purge pulses) ;cnst2 : J(FH) ;OTHER ;ns: 2 * n, total number of scans: NS * TD0 ;ds: 2 ;set O2 on resonance to the 19F signal of interest