Table 2.
HSHE | HSWH | HSCA | HSHU | HSCP | RT (min) | Measured (m/z) | Calculated (m/z) | Error (ppm) | C:DB | TAG Identity |
---|---|---|---|---|---|---|---|---|---|---|
1.35 | 888.70819 | 888.70756 | 0.71 | 54:10 | 18:4/18:3/18:3 | |||||
1.45 | 890.72369 | 890.72321 | 0.54 | 54:9 | 18:4/18:3/18:2 | |||||
1.70 | 962.81750 | 962.81711 | 0.41 | 59:8 | NI | |||||
1.70 | 892.74231 | 892.73886 | 3.86 | 54:8 | 18:3/18:3/18:2 | |||||
1.70 | 866.72357 | 866.72321 | 0.42 | 52:7 | 18:4/18:3/16:0 | |||||
1.95 | 894.75446 | 894.75451 | 0.06 | 54:7 | 18:3/18:2/18:2 | |||||
1.95 | 868.74005 | 868.73886 | 1.37 | 52:6 | 18:3/18:3/16:0 | |||||
1.95 | 922.78534 | 922.78581 | 0.51 | 56:7 | 20:0/18:4/18:0 | |||||
2.35 | 896.76996 | 896.77016 | 0.22 | 54:6 | 18:3/18:2/18:1 | |||||
2.35 | 870.75519 | 870.75451 | 0.78 | 52:5 | 18:3/18:2/16:0 | |||||
2.35 | 844.73926 | 844.73886 | 0.47 | 50:4 | NI | |||||
2.35 | 966.84924 | 966.84841 | 0.86 | 59:6 | NI | |||||
2.56 | 872.76996 | 872.77016 | 0.23 | 52:4 | 18:2/18:2/16:0 | |||||
2.70 | 898.78320 | 898.78581 | 2.90 | 54:5 | 18:2/18:2/18:1; 18:3/18:2/18:0 | |||||
2.70 | 924.80255 | 924.80146 | 1.18 | 56:6 | 20:1/18:3/18:2 | |||||
2.91 | 886.78650 | 886.78581 | 0.78 | 53:4 | 18:2/18:2/17:0 | |||||
3.15 | 900.80005 | 900.80146 | 1.57 | 54:4 | 18:2/18:2/18:0; 18:2/18:1/18:1 | |||||
3.15 | 874.78625 | 874.78581 | 0.50 | 52:3 | 18:2/18:1/16:0 | |||||
3.15 | 848.77167 | 848.77016 | 1.78 | 50:2 | 18:2/16:0/16:0 | |||||
3.15 | 926.81543 | 926.81711 | 1.81 | 56:5 | 20:1/18:2/18:2; 20:0/18:3/18:2 | |||||
3.40 | 928.83148 | 928.83276 | 1.38 | 56:4 | 20:0/18:2/18:2 | |||||
3.40 | 876.80115 | 876.80146 | 0.35 | 52:2 | 18:2/18:0/16:0; 18:1/18:1/16:0 | |||||
3.40 | 902.81738 | 902.81711 | 0.30 | 54:3 | 18:2/18:1/18:0 | |||||
3.40 | 954.84802 | 954.84841 | 0.41 | 58:5 | 22:0/18:3/18:2 | |||||
3.70 | 980.86426 | 980.86406 | 0.20 | 60:6 | NI | |||||
3.70 | 968.86395 | 968.86406 | 0.11 | 59:5 | 23:0/18:3/18:2 | |||||
3.70 | 904.83282 | 904.83276 | 0.07 | 54:2 | 20:0/18:2/16:0 | |||||
3.85 | 930.84845 | 930.84841 | 0.04 | 56:3 | 20:0/18:2/18:1 | |||||
3.95 | 956.86414 | 956.86406 | 0.08 | 58:4 | 22:0/18:2/18:2 | |||||
3.95 | 982.87933 | 982.87971 | 0.39 | 60:5 | 24:0/18:3/18:2 | |||||
4.17 | 970.88013 | 970.87971 | 0.43 | 59:4 | 23:0/18:2/18:2 | |||||
4.21 | 932.86420 | 932.86406 | 0.15 | 56:2 | 22:0/18:2/16:0; 20:0/18:1/18:1; 20:0/18:2/18:0 | |||||
4.21 | 958.87958 | 958.87971 | 0.14 | 58:3 | 22:0/18:2/18:1 | |||||
4.21 | 984.89496 | 984.89536 | 0.41 | 60:4 | 24:0/18:2/18:2 | |||||
4.35 | 958.87994 | 958.87971 | 0.24 | 58:3 | 20:3/20:0/18:0 | |||||
4.35 | 932.86432 | 932.86406 | 0.28 | 56:2 | 20:0/18:1/18:1 | |||||
4.84 | 960.89569 | 960.89536 | 0.34 | 58:2 | 22:0/18:1/18:1 | |||||
4.84 | 986.91125 | 986.911 | 0.25 | 60:3 | 24:0/18:2/18:1 | |||||
5.00 | 988.92682 | 988.92666 | 0.16 | 60:2 | 24:0/18:1/18:1 | |||||
5.00 | 896.77002 | 896.77016 | 0.16 | 54:6 | 18:3/18:2/18:1 | |||||
5.00 | 1014.94234 | 1014.94231 | 0.03 | 62:3 | NI |
NI—Fatty acid was not identified. Low Abundance High Abundance.