CID 363448

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

Structural Information

Molecular Formula
C10H7BrN2O2
SMILES
CC1=C(N=C2C(=N1)C(=O)C=C(C2=O)Br)C
InChI
InChI=1S/C10H7BrN2O2/c1-4-5(2)13-9-8(12-4)7(14)3-6(11)10(9)15/h3H,1-2H3
InChIKey
LEQZSMAFQOJHKY-UHFFFAOYSA-N
Compound name
6-bromo-2,3-dimethylquinoxaline-5,8-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

265.9691 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 266.97638 144.6
[M+Na]+ 288.95832 159.7
[M-H]- 264.96182 150.3
[M+NH4]+ 284.00292 164.3
[M+K]+ 304.93226 148.2
[M+H-H2O]+ 248.96636 144.2
[M+HCOO]- 310.96730 163.1
[M+CH3COO]- 324.98295 195.4
[M+Na-2H]- 286.94377 152.2
[M]+ 265.96855 165.2
[M]- 265.96965 165.2
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

No patent data available for this compound.