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]+ 386.18630 197.4
[M+Na]+ 408.16824 211.4
[M+NH4]+ 403.21284 200.9
[M+K]+ 424.14218 201.3
[M-H]- 384.17174 195.9
[M+Na-2H]- 406.15369 203.0
[M]+ 385.17847 198.2
[M]- 385.17957 198.2
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.