CID 14471161

6-methyl-7-nitroquinoxaline-2,3-diol

Structural Information

Molecular Formula
C9H7N3O4
SMILES
CC1=CC2=C(C=C1[N+](=O)[O-])NC(=O)C(=O)N2
InChI
InChI=1S/C9H7N3O4/c1-4-2-5-6(3-7(4)12(15)16)11-9(14)8(13)10-5/h2-3H,1H3,(H,10,13)(H,11,14)
InChIKey
VREQQHQFADBYHT-UHFFFAOYSA-N
Compound name
6-methyl-7-nitro-1,4-dihydroquinoxaline-2,3-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

22
Patents

221.04366 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 222.05094 141.2
[M+Na]+ 244.03288 155.7
[M+NH4]+ 239.07748 147.4
[M+K]+ 260.00682 153.4
[M-H]- 220.03638 142.2
[M+Na-2H]- 242.01833 146.1
[M]+ 221.04311 143.2
[M]- 221.04421 143.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe