CID 3699799

11,12-dimethyldibenzo[a,c]phenazine

Structural Information

Molecular Formula
C22H16N2
SMILES
CC1=CC2=C(C=C1C)N=C3C4=CC=CC=C4C5=CC=CC=C5C3=N2
InChI
InChI=1S/C22H16N2/c1-13-11-19-20(12-14(13)2)24-22-18-10-6-4-8-16(18)15-7-3-5-9-17(15)21(22)23-19/h3-12H,1-2H3
InChIKey
RYQVGAUFQMMZHI-UHFFFAOYSA-N
Compound name
11,12-dimethylphenanthro[9,10-b]quinoxaline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

308.13135 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.13863 174.9
[M+Na]+ 331.12057 188.1
[M-H]- 307.12407 180.3
[M+NH4]+ 326.16517 191.2
[M+K]+ 347.09451 179.3
[M+H-H2O]+ 291.12861 163.8
[M+HCOO]- 353.12955 193.3
[M+CH3COO]- 367.14520 186.5
[M+Na-2H]- 329.10602 185.8
[M]+ 308.13080 178.9
[M]- 308.13190 178.9
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

patents stripe