Common Name
LM ID
Instrument
Adduct / Ion
Submitter
20-epi-20-F3t-NeuroP-DPAn-3
Thermo Scientific Q Exactive Focus Orbitrap LC-MS/MS System
[M-H]-
Jean-Marie Galano.Ángel Sánchez Illana.Thierry Durand
[{"mz":52.6308,"intensity":1300},{"mz":57.033,"intensity":41000},{"mz":57.9904,"intensity":1200},{"mz":58.7081,"intensity":1300},{"mz":59.0124,"intensity":27000},{"mz":60.4737,"intensity":1600},{"mz":61.9871,"intensity":4000},{"mz":62.0876,"intensity":1400},{"mz":69.0332,"intensity":5800},{"mz":71.0123,"intensity":56000},{"mz":71.0488,"intensity":28000},{"mz":73.0281,"intensity":5500},{"mz":75.5321,"intensity":1500},{"mz":76.3209,"intensity":1600},{"mz":81.033,"intensity":1500},{"mz":83.0488,"intensity":50000},{"mz":85.2438,"intensity":1500},{"mz":87.0073,"intensity":48000},{"mz":89.6761,"intensity":1900},{"mz":92.2744,"intensity":4200},{"mz":93.0695,"intensity":3700},{"mz":94.8121,"intensity":9500},{"mz":95.0488,"intensity":45000},{"mz":96.9585,"intensity":1600},{"mz":97.0644,"intensity":66000},{"mz":98.5974,"intensity":1500},{"mz":99.0438,"intensity":23000},{"mz":109.0644,"intensity":12000},{"mz":109.0885,"intensity":1800},{"mz":111.0801,"intensity":17000},{"mz":112.9849,"intensity":2400},{"mz":113.0594,"intensity":59000},{"mz":113.0959,"intensity":2700},{"mz":114.9442,"intensity":1700},{"mz":116.9271,"intensity":10000},{"mz":118.9648,"intensity":3400},{"mz":121.1013,"intensity":2000},{"mz":123.0802,"intensity":22000},{"mz":125.0957,"intensity":4600},{"mz":127.038,"intensity":1500},{"mz":127.1113,"intensity":21000},{"mz":128.7701,"intensity":1500},{"mz":129.7079,"intensity":1700},{"mz":130.8768,"intensity":1900},{"mz":130.9652,"intensity":7400},{"mz":133.1011,"intensity":13000},{"mz":135.1165,"intensity":5900},{"mz":137.059,"intensity":2100},{"mz":137.096,"intensity":3900},{"mz":138.0675,"intensity":21000},{"mz":139.0754,"intensity":5700},{"mz":141.0909,"intensity":40000},{"mz":142.0739,"intensity":1500},{"mz":143.0695,"intensity":3400},{"mz":143.106,"intensity":9300},{"mz":146.9599,"intensity":170000},{"mz":147.1165,"intensity":8500},{"mz":149.0958,"intensity":5000},{"mz":151.1116,"intensity":11000},{"mz":153.0912,"intensity":2200},{"mz":153.1271,"intensity":11000},{"mz":155.1057,"intensity":3800},{"mz":158.9776,"intensity":35000},{"mz":160.3421,"intensity":1700},{"mz":163.1118,"intensity":7200},{"mz":165.1281,"intensity":4000},{"mz":167.1067,"intensity":21000},{"mz":169.1227,"intensity":7600},{"mz":173.5515,"intensity":1700},{"mz":174.9237,"intensity":18000},{"mz":174.955,"intensity":3600000},{"mz":175.0595,"intensity":1900},{"mz":175.4387,"intensity":1800},{"mz":175.8646,"intensity":2300},{"mz":175.9585,"intensity":8400},{"mz":176.5073,"intensity":1900},{"mz":178.478,"intensity":1800},{"mz":179.1066,"intensity":17000},{"mz":181.1082,"intensity":2800},{"mz":181.1224,"intensity":270000},{"mz":181.1346,"intensity":2000},{"mz":187.1484,"intensity":7400},{"mz":189.1633,"intensity":1800},{"mz":191.1068,"intensity":39000},{"mz":193.1224,"intensity":91000},{"mz":195.1381,"intensity":14000},{"mz":201.1629,"intensity":2500},{"mz":209.1548,"intensity":1700},{"mz":215.1793,"intensity":5300},{"mz":219.1385,"intensity":2200},{"mz":221.154,"intensity":4500},{"mz":227.179,"intensity":13000},{"mz":233.1553,"intensity":2200},{"mz":233.1906,"intensity":17000},{"mz":239.1643,"intensity":100000},{"mz":241.1956,"intensity":55000},{"mz":242.9433,"intensity":160000},{"mz":243.0187,"intensity":2600},{"mz":245.2273,"intensity":2300},{"mz":247.1706,"intensity":26000},{"mz":249.1862,"intensity":51000},{"mz":253.1934,"intensity":2600},{"mz":255.2112,"intensity":27000},{"mz":259.1703,"intensity":110000},{"mz":259.1964,"intensity":2100},{"mz":259.2059,"intensity":14000},{"mz":261.1857,"intensity":130000},{"mz":267.6386,"intensity":1700},{"mz":271.1703,"intensity":26000},{"mz":271.2004,"intensity":2100},{"mz":271.2434,"intensity":2500},{"mz":273.1909,"intensity":2700},{"mz":273.2222,"intensity":66000},{"mz":275.2014,"intensity":33000},{"mz":277.1521,"intensity":6900},{"mz":277.1807,"intensity":300000},{"mz":279.1961,"intensity":2400},{"mz":281.2273,"intensity":130000},{"mz":282.8781,"intensity":47000},{"mz":285.1532,"intensity":5500},{"mz":285.1859,"intensity":460000},{"mz":285.2179,"intensity":2800},{"mz":287.2014,"intensity":47000},{"mz":289.181,"intensity":40000},{"mz":289.2172,"intensity":150000},{"mz":291.2317,"intensity":2800},{"mz":292.395,"intensity":1900},{"mz":299.2021,"intensity":200000},{"mz":299.2371,"intensity":46000},{"mz":303.1966,"intensity":450000},{"mz":305.2127,"intensity":6600},{"mz":307.2285,"intensity":78000},{"mz":310.8719,"intensity":84000},{"mz":311.1686,"intensity":2500},{"mz":315.2326,"intensity":57000},{"mz":317.2121,"intensity":880000},{"mz":317.2423,"intensity":8100},{"mz":321.2076,"intensity":64000},{"mz":325.2172,"intensity":720000},{"mz":325.6811,"intensity":1800},{"mz":331.9673,"intensity":2000},{"mz":333.1558,"intensity":13000},{"mz":333.1933,"intensity":2200},{"mz":333.2406,"intensity":2500},{"mz":335.1812,"intensity":4200},{"mz":335.2228,"intensity":1200000},{"mz":341.2114,"intensity":2300},{"mz":343.2278,"intensity":530000},{"mz":343.2609,"intensity":2000},{"mz":361.1721,"intensity":2300},{"mz":361.193,"intensity":6800},{"mz":361.2386,"intensity":600000},{"mz":361.2726,"intensity":6800},{"mz":379.1163,"intensity":2500},{"mz":379.1478,"intensity":20000},{"mz":379.249,"intensity":5700000},{"mz":379.3274,"intensity":6900},{"mz":379.3486,"intensity":15000},{"mz":379.377,"intensity":3500},{"mz":527.9358,"intensity":1800},{"mz":629.2967,"intensity":2000},{"mz":634.719,"intensity":1900},{"mz":1007.3129,"intensity":2000}]
Structure
Common name
20-epi-20-F3t-NeuroP-DPAn-3
LMID
Systematic name
12-((1S,2R,3R,5S)-3,5-dihydroxy-3R-hydroxy-1E-penten-1-yl)cyclopentyl)-dodeca-7Z,10Z-dienoic acid
m/z
379.2494
Adduct / Ion
[M-H]-
Charge
-1
Ion source
ESI
Instrument
Thermo Scientific Q Exactive Focus Orbitrap LC-MS/MS System
Resolution
17000
For high resolution data only
Ion mode
Negative
Collision Energy (CE)
30eV
Column
Kinetex EVO C18 (100 × 2.1 mm column 1.7 µm)
Mobile phase A
0.3 mL/min binary gradient using H2O (0.1% HCOOH)
Mobile phase B
CH3CN:CH3OH 8:2, (0.1% HCOOH)
Retention time (min)
11.65
Amount injected
5μl
DOI for method
Date acquired
October 2023
Submitters
Jean-Marie Galano.Ángel Sánchez Illana.Thierry Durand
Source of standard
Synthesized in-house