Name | Value |
---|---|
InChI=1S/C10H11N3O2/c1-2-15-10(14)13-9-11-7-5-3-4-6-8(7)12-9/h3-6H,2H2,1H3,(H2,11,12,13,14) | |
OKOVSTKGUBOSTB-UHFFFAOYSA-N | |
C10H11N3O2 | |
205.085126592 | |
OC(=NC1=NC=2C=CC=CC2N1)OCC |
External Identifier | Value |
---|---|
6306-71-4 | |
D04754 | |
22752 | |
21329 |
Name | Value |
---|---|
ET270104 | |
2016.12.08 | |
Michael Stravs, Francesco Pomati, Juliane Hollender | |
CC BY-SA | |
Copyright (C) Michael Stravs @ Eawag | |
205.0851 | |
Q-Exactive + Thermo Scientific | |
LC-ESI-QFT | |
MS2 | |
ESI | |
HCD | |
60 % (nominal) | |
17500 | |
Atlantis T3 3um, 3.0x150mm, Waters | |
87/13 at 0 min, 87/13 at 5 min, 5/95 at 20 min, 5/95 at 29 min, 87/13 at 29.5 min, 87/13 at 35 min | |
300 uL/min | |
15.185 min | |
water with 0.1% formic acid | |
MeOH with 0.1% formic acid | |
loess on assigned fragments and MS1 | |
Peaks with additional N2/O included | |
RMassBank 1.99.11 | |
positive | |
1.170433769177148 | |
0.3907003905220817 | |
206.0924 | |
[M+H]+ | |
3.3799984861016408 ppm | |
-6.965919999970538E-4 Da |