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. Author manuscript; available in PMC: 2018 Mar 15.
Published in final edited form as: Chemometr Intell Lab Syst. 2016 Dec 23;162:10–20. doi: 10.1016/j.chemolab.2016.12.010

Table 2.

Data set identifiers, corresponding NMR frequencies, and laboratory-outlier identifications for the synthetic samples

Data set identifier NMR field strength (MHz) Outlier
0115 600
0122 500
0258 600
0333 500
0711 600
0714 800 ×
2861 500
7042 800 ×
8865 500
9541 600 ×