CID 363449

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

Structural Information

Molecular Formula
C10H7ClN2O2
SMILES
CC1=C(N=C2C(=N1)C(=O)C=C(C2=O)Cl)C
InChI
InChI=1S/C10H7ClN2O2/c1-4-5(2)13-9-8(12-4)7(14)3-6(11)10(9)15/h3H,1-2H3
InChIKey
XRMUPGHNEKEVNX-UHFFFAOYSA-N
Compound name
6-chloro-2,3-dimethylquinoxaline-5,8-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

222.0196 Da
Monoisotopic Mass

1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 223.02688 142.5
[M+Na]+ 245.00882 155.8
[M-H]- 221.01232 145.4
[M+NH4]+ 240.05342 161.1
[M+K]+ 260.98276 151.0
[M+H-H2O]+ 205.01686 136.4
[M+HCOO]- 267.01780 158.7
[M+CH3COO]- 281.03345 189.6
[M+Na-2H]- 242.99427 148.5
[M]+ 222.01905 146.5
[M]- 222.02015 146.5
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.