CID 265509

2,3-dimethyl-5,8-quinoxalinedione

Structural Information

Molecular Formula

C₁₀H₈N₂O₂

SMILES

CC1=C(N=C2C(=O)C=CC(=O)C2=N1)C

InChI

InChI=1S/C10H8N2O2/c1-5-6(2)12-10-8(14)4-3-7(13)9(10)11-5/h3-4H,1-2H3

InChIKey

HCYDPFOIMPYWPT-UHFFFAOYSA-N

Compound name

2,3-dimethylquinoxaline-5,8-dione

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 2
Patents: 188.05858 Da
Monoisotopic Mass: 0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	189.06586	136.9
[M+Na]+	211.04780	148.7
[M-H]-	187.05130	139.8
[M+NH4]+	206.09240	155.8
[M+K]+	227.02174	145.5
[M+H-H2O]+	171.05584	130.0
[M+HCOO]-	233.05678	157.8
[M+CH3COO]-	247.07243	184.5
[M+Na-2H]-	209.03325	144.1
[M]+	188.05803	138.7
[M]-	188.05913	138.7

Literature stripe

literature stripe

Patent stripe

patents stripe