Name | Value |
---|---|
InChI=1S/C8H11NO/c1-9(2)7-4-3-5-8(10)6-7/h3-6,10H,1-2H3 | |
MESJRHHDBDCQTH-UHFFFAOYSA-N | |
C8H11NO | |
137.084063972 | |
OC1=CC=CC(=C1)N(C)C |
External Identifier | Value |
---|---|
99-07-0 | |
7421 | |
7143 |
Name | Value |
---|---|
2020.08.19 | |
LU073905 | |
Kondić, T.;Singh, R.;Elapavalore, A.;Schymanski, E. | |
CC0 | |
Copyright © 2019 by Environmental Cheminformatics, LCSB, University of Luxembourg, Luxembourg | |
137.0841 | |
Q Exactive Orbitrap (Thermo Scientific) | |
LC-ESI-QFT | |
MS2 | |
ESI | |
HCD | |
75 | |
17500 | |
Acquity BEH C18 1.7um, 2.1x150mm (Waters) | |
90/10 at 0-2 min, 0/100 at 15-20 min, 90/10 at 20.1-30 min | |
0.20 mL/min | |
9.936 min | |
0.1% formic acid | |
methanol | |
16536192.71875 | |
loess on assigned fragments and MS1 | |
Peaks with additional N2/O included | |
RMassBank 2.99.2 | |
positive | |
1.7092287161677504 | |
0.5310017562537492 | |
138.0913 | |
[M+H]+ | |
5.315121227811843 ppm | |
-7.339720000061334E-4 Da |