Name | Value |
---|---|
InChI=1S/C16H14FN3O/c1-20-14-7-6-10(18)8-12(14)16(19-9-15(20)21)11-4-2-3-5-13(11)17/h2-8H,9,18H2,1H3 | |
LTCDLGUFORGHGY-UHFFFAOYSA-N | |
C16H14FN3O | |
283.112090288 | |
O=C1N(C=2C=CC(N)=CC2C(=NC1)C=3C=CC=CC3F)C |
External Identifier | Value |
---|---|
34084-50-9 | |
92294 | |
83325 |
Name | Value |
---|---|
EQ371901 | |
2015.08.25 | |
Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag and Thomaidis N, University of Athens | |
CC BY | |
Copyright (C) 2015 Eawag, Duebendorf, Switzerland | |
283.11209 | |
Q Exactive Plus Orbitrap Thermo Scientific | |
LC-ESI-QFT | |
MS2 | |
ESI | |
HCD | |
15 (nominal) | |
35000 | |
XBridge C18 3.5um, 2.1x50mm, Waters | |
90/10 at 0 min, 50/50 at 4 min, 5/95 at 17 min, 5/95 at 25 min, 90/10 at 25.1 min, 90/10 at 30 min | |
200 ul/min | |
4.9 min | |
water with 0.1% formic acid | |
methanol with 0.1% formic acid | |
loess on assigned fragments and MS1 | |
Peaks with additional N2/O included | |
RMassBank 1.9.6 | |
positive | |
0.0 | |
NaN | |
284.1194 | |
[M+H]+ | |
2.323980692645235 ppm | |
-6.602880000059486E-4 Da |