Name | Value |
---|---|
InChI=1S/C9H16ClN4/c10-2-1-3-14-7-11-4-12(8-14)6-13(5-11)9-14/h1-2H,3-9H2/q+1/b2-1- | |
LDLCEGCJYSDJLX-UPHRSURJSA-N | |
[C9H16ClN4]+ | |
215.10580061209072 | |
ClC=CC[N+]12CN3CN(CN(C3)C1)C2 |
External Identifier | Value |
---|---|
5846454 | |
4721001 |
Name | Value |
---|---|
AU242302 | |
2019.04.05 | |
Nikiforos Alygizakis, Katerina Galani, Nikolaos Thomaidis, University of Athens | |
CC BY | |
RMassBank 2.10.1 | |
Copyright (C) 2019 Department of Chemistry, University of Athens | |
215.1063492 | |
Bruker maXis Impact | |
LC-ESI-QTOF | |
MS2 | |
ESI | |
CID | |
20 eV | |
35000 | |
Acclaim RSLC C18 2.2um, 2.1x100mm, Thermo | |
99/1 at 0-1 min, 61/39 at 3 min, 0.1/99.9 at 14-16 min, 99/1 at 16.1-20 min | |
200 uL/min at 0-3 min, 400 uL/min at 14 min, 480 uL/min at 16-19 min, 200 uL/min at 19.1-20 min | |
8.265 min | |
90:10 water:methanol with 0.01% formic acid and 5mM ammonium formate | |
methanol with 0.01% formic acid and 5mM ammonium formate | |
identity on assigned fragments and MS1 | |
positive | |
0.0 | |
NaN | |
216.1136 | |
[M+H]+ | |
0.7894555952388834 ppm | |
-1.7061209072721795E-4 Da |