CID 363446

Nsc628357

Structural Information

Molecular Formula
C14H17N3O2
SMILES
CCN(CC)C1=CC(=O)C2=NC(=C(N=C2C1=O)C)C
InChI
InChI=1S/C14H17N3O2/c1-5-17(6-2)10-7-11(18)12-13(14(10)19)16-9(4)8(3)15-12/h7H,5-6H2,1-4H3
InChIKey
KMDYJZSRJSMBBI-UHFFFAOYSA-N
Compound name
6-(diethylamino)-2,3-dimethylquinoxaline-5,8-dione
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.13208 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.13936 159.3
[M+Na]+ 282.12130 169.3
[M-H]- 258.12480 163.1
[M+NH4]+ 277.16590 175.7
[M+K]+ 298.09524 166.5
[M+H-H2O]+ 242.12934 151.2
[M+HCOO]- 304.13028 180.2
[M+CH3COO]- 318.14593 206.2
[M+Na-2H]- 280.10675 163.3
[M]+ 259.13153 163.3
[M]- 259.13263 163.3
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.