Name | Value |
---|---|
InChI=1S/C8H10ClN/c1-10(2)8-5-3-7(9)4-6-8/h3-6H,1-2H3 | |
IONGEXNDPXANJD-UHFFFAOYSA-N | |
C8H10ClN | |
155.050177 | |
ClC1=CC=C(C=C1)N(C)C |
External Identifier | Value |
---|---|
698-69-1 | |
136530 | |
21539183 |
Name | Value |
---|---|
EQ347703 | |
2015.08.25 | |
Beck B, Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag | |
CC BY | |
Copyright (C) 2015 Eawag, Duebendorf, Switzerland | |
155.05018 | |
Q Exactive Plus Orbitrap Thermo Scientific | |
LC-ESI-QFT | |
MS2 | |
ESI | |
HCD | |
45 (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 | |
7.1 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 | |
0.8181134143615274 | |
0.5083224447746603 | |
156.0575 | |
[M+H]+ | |
4.145907758271916 ppm | |
-6.469999999865195E-4 Da |