CID 3075341

176915-32-5

Structural Information

Molecular Formula
C20H24N4O5
SMILES
CN(C)CCCN(C1=C2C(=C(C=C(C2=NC3=CC=CC=C31)OC)OC)[N+](=O)[O-])O
InChI
InChI=1S/C20H24N4O5/c1-22(2)10-7-11-23(25)19-13-8-5-6-9-14(13)21-18-15(28-3)12-16(29-4)20(17(18)19)24(26)27/h5-6,8-9,12,25H,7,10-11H2,1-4H3
InChIKey
HYCRBFMIRZGESO-UHFFFAOYSA-N
Compound name
N-(2,4-dimethoxy-1-nitroacridin-9-yl)-N-[3-(dimethylamino)propyl]hydroxylamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

400.17468 Da
Monoisotopic Mass

3.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 401.18196 191.7
[M+Na]+ 423.16390 205.0
[M+NH4]+ 418.20850 197.9
[M+K]+ 439.13784 201.5
[M-H]- 399.16740 196.3
[M+Na-2H]- 421.14935 196.6
[M]+ 400.17413 194.7
[M]- 400.17523 194.7
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.