CID 342820

Alpha-((9-acridinyloxy)methyl)-4-methyl-1-piperazineethanol

Structural Information

Molecular Formula
C21H25N3O2
SMILES
CN1CCN(CC1)CC(COC2=C3C=CC=CC3=NC4=CC=CC=C42)O
InChI
InChI=1S/C21H25N3O2/c1-23-10-12-24(13-11-23)14-16(25)15-26-21-17-6-2-4-8-19(17)22-20-9-5-3-7-18(20)21/h2-9,16,25H,10-15H2,1H3
InChIKey
WDRFSSXMFZWUNJ-UHFFFAOYSA-N
Compound name
1-acridin-9-yloxy-3-(4-methylpiperazin-1-yl)propan-2-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

351.19467 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 352.20195 186.6
[M+Na]+ 374.18389 201.7
[M+NH4]+ 369.22849 194.3
[M+K]+ 390.15783 193.0
[M-H]- 350.18739 190.4
[M+Na-2H]- 372.16934 193.4
[M]+ 351.19412 189.9
[M]- 351.19522 189.9
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

No patent data available for this compound.