CID 209620

20063-39-2

Structural Information

Molecular Formula
C23H23ClN2O2
SMILES
C1CN(C(N1CC2=CC=CC=C2O)C3=CC=C(C=C3)Cl)CC4=CC=CC=C4O
InChI
InChI=1S/C23H23ClN2O2/c24-20-11-9-17(10-12-20)23-25(15-18-5-1-3-7-21(18)27)13-14-26(23)16-19-6-2-4-8-22(19)28/h1-12,23,27-28H,13-16H2
InChIKey
SGPZQAAZPZKJQK-UHFFFAOYSA-N
Compound name
2-[[2-(4-chlorophenyl)-3-[(2-hydroxyphenyl)methyl]imidazolidin-1-yl]methyl]phenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

394.1448 Da
Monoisotopic Mass

4.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 395.15208 195.4
[M+Na]+ 417.13402 202.6
[M-H]- 393.13752 202.7
[M+NH4]+ 412.17862 204.7
[M+K]+ 433.10796 193.8
[M+H-H2O]+ 377.14206 184.8
[M+HCOO]- 439.14300 207.1
[M+CH3COO]- 453.15865 203.7
[M+Na-2H]- 415.11947 193.4
[M]+ 394.14425 194.6
[M]- 394.14535 194.6
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.