CID 363444

6-amino-2,3-dimethylquinoxaline-5,8-dione

Structural Information

Molecular Formula
C10H9N3O2
SMILES
CC1=C(N=C2C(=N1)C(=O)C=C(C2=O)N)C
InChI
InChI=1S/C10H9N3O2/c1-4-5(2)13-9-8(12-4)7(14)3-6(11)10(9)15/h3H,11H2,1-2H3
InChIKey
PULMCFDLNMPHJH-UHFFFAOYSA-N
Compound name
6-amino-2,3-dimethylquinoxaline-5,8-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

203.06947 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.07675 142.6
[M+Na]+ 226.05869 154.4
[M-H]- 202.06219 145.2
[M+NH4]+ 221.10329 160.5
[M+K]+ 242.03263 150.7
[M+H-H2O]+ 186.06673 135.5
[M+HCOO]- 248.06767 163.8
[M+CH3COO]- 262.08332 190.2
[M+Na-2H]- 224.04414 148.3
[M]+ 203.06892 143.0
[M]- 203.07002 143.0
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

No patent data available for this compound.