CID 209618

20063-36-9

Structural Information

Molecular Formula
C24H23N3O2
SMILES
C1CN(C(N1CC2=CC=CC=C2O)C3=CC=C(C=C3)C#N)CC4=CC=CC=C4O
InChI
InChI=1S/C24H23N3O2/c25-15-18-9-11-19(12-10-18)24-26(16-20-5-1-3-7-22(20)28)13-14-27(24)17-21-6-2-4-8-23(21)29/h1-12,24,28-29H,13-14,16-17H2
InChIKey
NQEIGYQGNOIBBY-UHFFFAOYSA-N
Compound name
4-[1,3-bis[(2-hydroxyphenyl)methyl]imidazolidin-2-yl]benzonitrile
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

385.17902 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 386.186296 196.2
[M+Na]+ 408.168238 204.7
[M-H]- 384.171744 200.7
[M+NH4]+ 403.212843 203.5
[M+K]+ 424.142178 194.4
[M+H-H2O]+ 368.176280 178.8
[M+HCOO]- 430.177221 208.7
[M+CH3COO]- 444.192871 202.6
[M+Na-2H]- 406.153686 193.8
[M]+ 385.17847142 187.9
[M]- 385.17956858 187.9
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.