CID 81109

6627-38-9

Structural Information

Molecular Formula
C20H16N4
SMILES
CC1=CC2=C(C=C1C)N=C(C(=N2)C3=CC=CC=N3)C4=CC=CC=N4
InChI
InChI=1S/C20H16N4/c1-13-11-17-18(12-14(13)2)24-20(16-8-4-6-10-22-16)19(23-17)15-7-3-5-9-21-15/h3-12H,1-2H3
InChIKey
NACXMBPTPBZQHY-UHFFFAOYSA-N
Compound name
6,7-dimethyl-2,3-dipyridin-2-ylquinoxaline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

9
References

58
Patents

312.13748 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.14476 179.0
[M+Na]+ 335.12670 189.4
[M-H]- 311.13020 184.4
[M+NH4]+ 330.17130 188.7
[M+K]+ 351.10064 181.0
[M+H-H2O]+ 295.13474 166.2
[M+HCOO]- 357.13568 196.3
[M+CH3COO]- 371.15133 188.9
[M+Na-2H]- 333.11215 186.1
[M]+ 312.13693 179.2
[M]- 312.13803 179.2
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