CID 9886593

Mln576

Structural Information

Molecular Formula
C23H24N4O2
SMILES
C[C@H](CN(C)C)NC(=O)C1=C2C(=CC=C1)N=C3C=CC4=C(C3=N2)C=CC=C4OC
InChI
InChI=1S/C23H24N4O2/c1-14(13-27(2)3)24-23(28)17-8-5-9-18-22(17)26-21-16-7-6-10-20(29-4)15(16)11-12-19(21)25-18/h5-12,14H,13H2,1-4H3,(H,24,28)/t14-/m1/s1
InChIKey
ACAXGYADTLFREX-CQSZACIVSA-N
Compound name
N-[(2R)-1-(dimethylamino)propan-2-yl]-4-methoxybenzo[a]phenazine-11-carboxamide
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

8
References

82
Patents

388.1899 Da
Monoisotopic Mass

3.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 389.19718 194.3
[M+Na]+ 411.17912 201.5
[M-H]- 387.18262 199.0
[M+NH4]+ 406.22372 205.9
[M+K]+ 427.15306 197.1
[M+H-H2O]+ 371.18716 183.3
[M+HCOO]- 433.18810 212.7
[M+CH3COO]- 447.20375 203.4
[M+Na-2H]- 409.16457 200.8
[M]+ 388.18935 199.5
[M]- 388.19045 199.5
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