Name | Value |
---|---|
InChI=1S/C6H4ClN3/c7-10-6-4-2-1-3-5(6)8-9-10/h1-4H | |
INOGLHRUEYDAHX-UHFFFAOYSA-N | |
C6H4ClN3 | |
153.009374808 | |
ClN1N=NC=2C=CC=CC21 |
External Identifier | Value |
---|---|
21050-95-3 | |
88761 | |
80093 |
Name | Value |
---|---|
CC BY | |
AU405511 | |
2016.02.26 | |
Nikiforos Alygizakis, Nikolaos Thomaidis, University of Athens | |
Copyright (C) 2016 Department of Chemistry, University of Athens | |
153.0093748 | |
Bruker maXis Impact | |
LC-ESI-QTOF | |
MS2 | |
ESI | |
CID | |
50 eV | |
35000 | |
ACQUITY UPLC BEH Amide 1.7 um 2.1x100mm, Water | |
0/100 at 0-2 min, 95/5 at 12 min, 95/5 at 17 min, 0/100 at 17.1, 0/100 at 25 min | |
200 uL/min | |
1.516 min | |
Water with 0.01% formic acid and 1mM ammonium formate | |
Acetonitrile:Water with 0.01% formic acid and 1mM ammonium formate | |
identity on assigned fragments and MS1 | |
RMassBank 1.99.10 | |
positive | |
0.0 | |
NaN | |
154.0167 | |
[M+H]+ | |
4.186610932477482 ppm | |
-6.448080000041045E-4 Da |