CID 467790

6-methyl-n2,n3-diphenyl-quinoxaline-2,3-diamine

Structural Information

Molecular Formula
C21H18N4
SMILES
CC1=CC2=C(C=C1)N=C(C(=N2)NC3=CC=CC=C3)NC4=CC=CC=C4
InChI
InChI=1S/C21H18N4/c1-15-12-13-18-19(14-15)25-21(23-17-10-6-3-7-11-17)20(24-18)22-16-8-4-2-5-9-16/h2-14H,1H3,(H,22,24)(H,23,25)
InChIKey
XUQVWCTUNCQTEO-UHFFFAOYSA-N
Compound name
6-methyl-2-N,3-N-diphenylquinoxaline-2,3-diamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

0
Patents

326.15314 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 327.16042 176.8
[M+Na]+ 349.14236 184.1
[M-H]- 325.14586 184.4
[M+NH4]+ 344.18696 187.8
[M+K]+ 365.11630 176.4
[M+H-H2O]+ 309.15040 165.1
[M+HCOO]- 371.15134 198.9
[M+CH3COO]- 385.16699 186.7
[M+Na-2H]- 347.12781 185.9
[M]+ 326.15259 175.0
[M]- 326.15369 175.0
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

No patent data available for this compound.