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. 2020 Sep 29;48(18):10101–10124. doi: 10.1093/nar/gkaa750

Table 1.

ΔδSR data for the (S)- and (R)-MTPA esters of 2326

23 24 ΔδSR ( = δS – δR)
Proton d (S)-Mosher ester d (R)-Mosher ester ppm Hz (400 MHz)
3′H 4.98 5.12 −0.14 −56
4′H 4.03 4.09 −0.06 −24
1′H 6.02 6.07 −0.05 −20
2′H 5.35 5.37 −0.02 −8
5′H 5.24 5.24 0 0
5′Me 1.23 1.13 0.1 40
25 26 ΔδSR ( = δS – δR)
Proton d (S)-Mosher ester d (R)-Mosher ester ppm Hz (400 MHz)
3′H 5.24 4.80 0.44 176
4′H 4.10 4.13 −0.03 –12
1′H 6.19 6.03 0.16 64
2′H 5.33 5.08 0.25 100
5′H 5.33 5.29 0.04 16
5′Me 1.26 1.35 −0.09 −36