CID 13073877

23593-71-7

Structural Information

Molecular Formula

C₂₂H₁₇ClN₂

SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=C(C=C3)Cl)N4C=CN=C4

InChI

InChI=1S/C22H17ClN2/c23-21-13-11-20(12-14-21)22(25-16-15-24-17-25,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-17H

InChIKey

BLNLHAFFGFCSRK-UHFFFAOYSA-N

Compound name

1-[(4-chlorophenyl)-diphenylmethyl]imidazole

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 27
Patents: 344.10803 Da
Monoisotopic Mass: 5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	345.115306	183.0
[M+Na]+	367.097248	190.6
[M-H]-	343.100754	192.3
[M+NH4]+	362.141853	194.8
[M+K]+	383.071188	182.1
[M+H-H2O]+	327.105290	171.7
[M+HCOO]-	389.106231	198.6
[M+CH3COO]-	403.121881	193.0
[M+Na-2H]-	365.082696	187.6
[M]+	344.10748142	183.1
[M]-	344.10857858	183.1

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe