CID 4193526

114991-95-6

Structural Information

Molecular Formula
C24H22N4O2
SMILES
CC(C)COC1=C(C=C(C=C1)C2=NC3=CC4=NC5=CC=CC=C5NC4=CC3=N2)OC
InChI
InChI=1S/C24H22N4O2/c1-14(2)13-30-22-9-8-15(10-23(22)29-3)24-27-20-11-18-19(12-21(20)28-24)26-17-7-5-4-6-16(17)25-18/h4-12,14,25H,13H2,1-3H3
InChIKey
TUIUJUKDUOQFFX-UHFFFAOYSA-N
Compound name
2-[3-methoxy-4-(2-methylpropoxy)phenyl]-10H-imidazo[4,5-b]phenazine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

398.1743 Da
Monoisotopic Mass

4.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 399.181576 199.3
[M+Na]+ 421.163518 210.2
[M-H]- 397.167024 203.3
[M+NH4]+ 416.208123 208.9
[M+K]+ 437.137458 202.0
[M+H-H2O]+ 381.171560 187.5
[M+HCOO]- 443.172501 214.8
[M+CH3COO]- 457.188151 208.2
[M+Na-2H]- 419.148966 204.2
[M]+ 398.17375142 205.3
[M]- 398.17484858 205.3
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

No patent data available for this compound.