Name | Value |
---|---|
InChI=1S/C14H15N/c1-2-5-13(6-3-1)7-4-8-14-9-11-15-12-10-14/h1-3,5-6,9-12H,4,7-8H2 | |
AQIIVEISJBBUCR-UHFFFAOYSA-N | |
C14H15N | |
197.12044948 | |
N=1C=CC(=CC1)CCCC=2C=CC=CC2 |
External Identifier | Value |
---|---|
2057-49-0 | |
74937 | |
67498 |
Name | Value |
---|---|
LU129904 | |
2020.08.19 | |
Kondić, T.;Singh, R.;Elapavalore, A.;Schymanski, E. | |
CC0 | |
Copyright © 2019 by Environmental Cheminformatics, LCSB, University of Luxembourg, Luxembourg | |
197.1204 | |
Q Exactive Orbitrap (Thermo Scientific) | |
LC-ESI-QFT | |
MS2 | |
ESI | |
HCD | |
60 | |
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 | |
13.113 min | |
0.1% formic acid | |
methanol | |
33764725.1875 | |
loess on assigned fragments and MS1 | |
Peaks with additional N2/O included | |
RMassBank 2.99.2 | |
positive | |
1.8002318528286354 | |
0.5913018838431618 | |
198.1277 | |
[M+H]+ | |
3.631395307100223 ppm | |
-7.194799999865609E-4 Da |