Appendix 270 Supplementary Table 5: Mass spectral ranges (mass/charge regions) defining the 274 features used in classifier development Lower m/Z Center m/Z Upper m/Z Lower m/Z Center m/Z Upper m/Z Lower m/Z Center m/Z Upper m/Z 3071.22 3085.19 3099.16 4397.29 4407.28 4417.26 5685.16 5693.39 5701.62 3099.64 3111.21 3122.77 4427.4 4433.22 4439.04 5701.82 5708.3 5714.77 3125.22 3137 3148.78 4439.75 4443.96 4448.18 5714.97 5720.49 5726.01 3149.02 3156.94 3164.86 4449.38 4461.23 4473.07 5726.03 5734.42 5742.81 3165.7 3177.13 3188.57 4502.53 4508.75 4514.98 5743.56 5750.24 5756.93 3189.67 3198.85 3208.03 4553.3 4565.57 4577.84 5757.29 5764.16 5771.03 3208.33 3216.82 3225.3 4580.87 4586.84 4592.81 5771.12 5778.62 5786.11 3231 3243.53 3256.07 4593.22 4599.59 4605.96 5786.29 5794.96 5803.62 3256.9 3267 3277.1 4618.51 4625.99 4633.46 5803.89 5810.08 5816.27 3305.44 3314.98 3324.51 4633.75 4642.42 4651.09 5816.42 5822.76 5829.11 3353.79 3366.37 3378.94 4667.54 4679.99 4692.43 5832.02 5840.46 5848.89 3384.77 3396.02 3407.27 4698.76 4713.31 4727.86 5850.08 5863.91 5877.73 3410.04 3422.21 3434.37 4747.49 4755.82 4764.15 5879.59 5888.74 5897.9 3434.51 3443.9 3453.3 4770.57 4776.34 4782.12 5898.07 5909.77 5921.47 3454.74 3466.38 3478.02 4782.62 4790.85 4799.08 5922.62 5934.73 5946.84 3540.72 3555.53 3570.35 4807.16 4819.05 4830.95 5949.41 5963.9 5978.4 3583.14 3593.09 3603.05 4845.9 4857.7 4869.49 5978.83 5987.76 5996.69 3667.06 3681.88 3696.7 4885.05 4893.33 4901.61 5998.01 6008.58 6019.14 3697.35 3705.33 3713.31 4910.19 4919.12 4928.06 6020.13 6028.93 6037.72 3747.09 3755.81 3764.52 4928.26 4938.24 4948.23 6054.61 6061.94 6069.27 3766.63 3776.4 3786.17 4949.44 4964.3 4979.15 6069.47 6082.86 6096.26 3811.87 3821.31 3830.74 4989.38 5000.07 5010.76 6099.57 6109.12 6118.68 3832 3841.64 3851.28 5012.17 5020.4 5028.63 6134.48 6148.68 6162.88 3860.09 3867.51 3874.93 5033.64 5041.17 5048.71 6165.75 6175.04 6184.34 3877.78 3888.14 3898.49 5048.95 5054.98 5061 6186.65 6194.45 6202.25 3899.28 3907.43 3915.58 5061.1 5070.88 5080.67 6202.33 6209.35 6216.38 3915.7 3927.75 3939.8 5093.87 5106.47 5119.06 6216.68 6224.86 6233.04 3943.3 3952.26 3961.21 5120.38 5127.97 5135.56 6275.16 6284.15 6293.14 3999.11 4011.41 4023.71 5162.99 5185.8 5208.61 6293.16 6301.49 6309.82 4023.91 4031.43 4038.96 5209.58 5224.44 5239.3 6322.27 6331.46 6340.64 4039.25 4051.4 4063.54 5240.4 5251.05 5261.69 6378.77 6393.09 6407.42 4080.14 4094.83 4109.53 5274.04 5288.09 5302.14 6409.41 6479.04 6548.68 4112.17 4119.37 4126.57 5351.59 5362.36 5373.12 6553.89 6564.68 6575.47 4127.25 4133.39 4139.52 5396.97 5404.07 5411.16 6575.85 6589.26 6602.67 4198.95 4210.81 4222.68 5411.52 5418.07 5424.63 6604.74 6675.06 6745.39
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