CID 16925

2,3-dimethylquinoxaline

Structural Information

Molecular Formula
C10H10N2
SMILES
CC1=NC2=CC=CC=C2N=C1C
InChI
InChI=1S/C10H10N2/c1-7-8(2)12-10-6-4-3-5-9(10)11-7/h3-6H,1-2H3
InChIKey
FKHNZQFCDGOQGV-UHFFFAOYSA-N
Compound name
2,3-dimethylquinoxaline
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

7
References

1290
Patents

158.0844 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.09168 131.7
[M+Na]+ 181.07362 142.2
[M-H]- 157.07712 134.1
[M+NH4]+ 176.11822 151.5
[M+K]+ 197.04756 138.9
[M+H-H2O]+ 141.08166 124.5
[M+HCOO]- 203.08260 153.2
[M+CH3COO]- 217.09825 145.7
[M+Na-2H]- 179.05907 141.4
[M]+ 158.08385 132.5
[M]- 158.08495 132.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe