CID 6482345

Chembl269923

Structural Information

Molecular Formula
C19H24N4
SMILES
C1CN(CN1CN2CCN(C2)C3=CC=CC=C3)C4=CC=CC=C4
InChI
InChI=1S/C19H24N4/c1-3-7-18(8-4-1)22-13-11-20(16-22)15-21-12-14-23(17-21)19-9-5-2-6-10-19/h1-10H,11-17H2
InChIKey
ZKMPAPGCXXQZJL-UHFFFAOYSA-N
Compound name
1-phenyl-3-[(3-phenylimidazolidin-1-yl)methyl]imidazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

0
Patents

308.2001 Da
Monoisotopic Mass

3.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 309.20738 174.3
[M+Na]+ 331.18932 178.7
[M-H]- 307.19282 180.8
[M+NH4]+ 326.23392 185.9
[M+K]+ 347.16326 173.1
[M+H-H2O]+ 291.19736 161.8
[M+HCOO]- 353.19830 190.0
[M+CH3COO]- 367.21395 183.1
[M+Na-2H]- 329.17477 172.4
[M]+ 308.19955 168.6
[M]- 308.20065 168.6
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

No patent data available for this compound.