Name | Value |
---|---|
InChI=1S/C6H4N2O4/c9-7(10)5-2-1-3-6(4-5)8(11)12/h1-4H | |
WDCYWAQPCXBPJA-UHFFFAOYSA-N | |
C6H4N2O4 | |
168.017106608 | |
O=N(=O)C1=CC=CC(=C1)N(=O)=O |
External Identifier | Value |
---|---|
99-65-0 | |
7452 | |
7172 |
Name | Value |
---|---|
UA003905 | |
2014.06.24 | |
C. Gallampois (Umea), E. Schymanski (Eawag), W. Brack (UFZ) | |
CC BY | |
Copyright (C) Eawag, 2014 | |
Multi-criteria approach for tentative identification of polyaromatic river mutagens | |
168.0171 | |
LTQ Orbitrap XL Thermo Scientific | |
APCI-ITFT | |
MS2 | |
APCI | |
CID | |
N/A | |
35 % (nominal) | |
30000 | |
Direct infusion experiment | |
5 uL/min | |
N/A min | |
methanol | |
N/A | |
loess on assigned fragments and MS1 | |
Peaks with additional N2/O included | |
RMassBank 1.5.2.3 | |
negative | |
0.0 | |
NaN | |
168.0177 | |
[M]- |