CID 3041243

Imidazolidine, 1,3-bis(3-chlorophenyl)-2-(trichloromethyl)-

Structural Information

Molecular Formula
C16H13Cl5N2
SMILES
C1CN(C(N1C2=CC=C(C=C2)Cl)C(Cl)(Cl)Cl)C3=CC=C(C=C3)Cl
InChI
InChI=1S/C16H13Cl5N2/c17-11-1-5-13(6-2-11)22-9-10-23(15(22)16(19,20)21)14-7-3-12(18)4-8-14/h1-8,15H,9-10H2
InChIKey
OZAXVHLTMCULJL-UHFFFAOYSA-N
Compound name
1,3-bis(4-chlorophenyl)-2-(trichloromethyl)imidazolidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

12
Patents

407.95215 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 408.959426 193.3
[M+Na]+ 430.941368 201.1
[M-H]- 406.944874 193.7
[M+NH4]+ 425.985973 203.1
[M+K]+ 446.915308 194.3
[M+H-H2O]+ 390.949410 184.0
[M+HCOO]- 452.950351 184.8
[M+CH3COO]- 466.966001 198.9
[M+Na-2H]- 428.926816 189.2
[M]+ 407.95160142 190.9
[M]- 407.95269858 190.9
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

patents stripe