Name | Value |
---|---|
C12H11N5O | |
241.09635997200002 | |
N1=CNC=2N=C(N=C(OCC=3C=CC=CC3)C12)N | |
InChI=1S/C12H11N5O/c13-12-16-10-9(14-7-15-10)11(17-12)18-6-8-4-2-1-3-5-8/h1-5,7H,6H2,(H3,13,14,15,16,17) | |
KRWMERLEINMZFT-UHFFFAOYSA-N |
Name | Value |
---|---|
ESI-ITFT | |
LTQ Orbitrap Fusion Tribrid, Thermo Scientfic | |
cid | |
50 | |
C12H11N5O1 | |
2 | |
20231130_DNA-Adduct_CombinedDB.msp | |
1.3023638978136058 | |
0.8092041872208178 | |
positive | |
242.103640025 | |
[M+H]+ | |
2.8498001927640595 ppm | |
-6.899470000121255E-4 Da |