Name | Value |
---|---|
InChI=1S/C20H23N/c1-21(2)15-7-12-20-18-10-5-3-8-16(18)13-14-17-9-4-6-11-19(17)20/h3-6,8-12H,7,13-15H2,1-2H3 | |
KRMDCWKBEZIMAB-UHFFFAOYSA-N | |
C20H23N | |
277.183049736 | |
C=1C=CC2=C(C1)C(=CCCN(C)C)C=3C=CC=CC3CC2 |
External Identifier | Value |
---|---|
50-48-6 | |
2666 | |
D07448 | |
2160 | |
2075 |
Name | Value |
---|---|
EA282106 | |
2014.01.14 | |
Stravs M, Schymanski E, Singer H, Department of Environmental Chemistry, Eawag | |
CC BY | |
Copyright (C) 2012 Eawag, Duebendorf, Switzerland | |
277.183 | |
LTQ Orbitrap XL Thermo Scientific | |
LC-ESI-ITFT | |
MS2 | |
ESI | |
HCD | |
75 % (nominal) | |
7500 | |
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 | |
8.6 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 | |
2.954640613411619 | |
0.8310411701783862 | |
278.1903 | |
[M+H]+ | |
2.587207390077017 ppm | |
-7.197360000077424E-4 Da |