CID 7035

Chlorodiphenylmethane

Structural Information

Molecular Formula
C13H11Cl
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)Cl
InChI
InChI=1S/C13H11Cl/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H
InChIKey
ZDVDCDLBOLSVGM-UHFFFAOYSA-N
Compound name
[chloro(phenyl)methyl]benzene
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

5
References

3956
Patents

202.05493 Da
Monoisotopic Mass

3.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 203.06221 141.6
[M+Na]+ 225.04415 149.3
[M-H]- 201.04765 147.9
[M+NH4]+ 220.08875 161.2
[M+K]+ 241.01809 144.1
[M+H-H2O]+ 185.05219 135.5
[M+HCOO]- 247.05313 160.8
[M+CH3COO]- 261.06878 154.9
[M+Na-2H]- 223.02960 148.6
[M]+ 202.05438 141.9
[M]- 202.05548 141.9
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