Name | Value |
---|---|
InChI=1S/C11H11N5/c1-6-5-13-7-3-4-8-10(9(7)14-6)15-11(12)16(8)2/h3-5H,1-2H3,(H2,12,15) | |
DVCCCQNKIYNAKB-UHFFFAOYSA-N | |
C11H11N5 | |
213.10144535199998 | |
N=C1NC2=C3N=C(C=NC3=CC=C2N1C)C |
External Identifier | Value |
---|---|
77500-04-0 | |
76604 | |
C19255 | |
62275 | |
56076 |
Name | Value |
---|---|
2019.04.05 | |
AU229201 | |
Nikiforos Alygizakis, Katerina Galani, Nikolaos Thomaidis, University of Athens | |
CC BY | |
Copyright (C) 2019 Department of Chemistry, University of Athens | |
213.1014454 | |
Bruker maXis Impact | |
LC-ESI-QTOF | |
MS2 | |
ESI | |
CID | |
10 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 | |
4.075 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 | |
RMassBank 2.10.0 | |
positive | |
0.3860544496604179 | |
0.3514019036947481 | |
214.1087 | |
[M+H]+ | |
3.3410692792309193 ppm | |
-7.153519999860691E-4 Da |