CID 75123

Bis(1,3-diphenyl-2-imidazolidinylidene)

Structural Information

Molecular Formula
C30H28N4
SMILES
C1CN(C(=C2N(CCN2C3=CC=CC=C3)C4=CC=CC=C4)N1C5=CC=CC=C5)C6=CC=CC=C6
InChI
InChI=1S/C30H28N4/c1-5-13-25(14-6-1)31-21-22-32(26-15-7-2-8-16-26)29(31)30-33(27-17-9-3-10-18-27)23-24-34(30)28-19-11-4-12-20-28/h1-20H,21-24H2
InChIKey
PIKIZMYRKVCCBT-UHFFFAOYSA-N
Compound name
2-(1,3-diphenylimidazolidin-2-ylidene)-1,3-diphenylimidazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

444.23138 Da
Monoisotopic Mass

7.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 445.23866 209.6
[M+Na]+ 467.22060 213.5
[M-H]- 443.22410 221.8
[M+NH4]+ 462.26520 214.5
[M+K]+ 483.19454 203.5
[M+H-H2O]+ 427.22864 194.4
[M+HCOO]- 489.22958 223.5
[M+CH3COO]- 503.24523 215.7
[M+Na-2H]- 465.20605 204.2
[M]+ 444.23083 201.8
[M]- 444.23193 201.8
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

patents stripe