Name | Value |
---|---|
InChI=1S/C10H15N/c1-9(11-2)8-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/t9-/m0/s1 | |
MYWUZJCMWCOHBA-VIFPVBQESA-N | |
C10H15N | |
149.12044948 | |
C=1C=CC(=CC1)CC(NC)C |
External Identifier | Value |
---|---|
537-46-2 | |
6809 | |
C07164 | |
10836 | |
10379 |
Name | Value |
---|---|
EA282913 | |
2014.01.14 | |
Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag | |
CC BY | |
Copyright (C) 2012 Eawag, Duebendorf, Switzerland | |
149.1204 | |
LTQ Orbitrap XL Thermo Scientific | |
LC-ESI-ITFT | |
MS2 | |
ESI | |
HCD | |
90 % (nominal) | |
30000 | |
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 | |
3.7 min | |
water with 0.1% formic acid | |
methanol with 0.1% formic acid | |
Spline | |
loess on assigned fragments and MS1 | |
Peaks with additional N2/O included | |
RMassBank 1.3.1 | |
positive | |
0.059198496864236796 | |
0.04270268892705764 | |
150.1277 | |
[M+H]+ | |
4.79245335795167 ppm | |
-7.194799999865609E-4 Da |