CID 4275903

23429-44-9

Structural Information

Molecular Formula
C20H17Cl
SMILES
CC1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)Cl
InChI
InChI=1S/C20H17Cl/c1-16-12-14-19(15-13-16)20(21,17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15H,1H3
InChIKey
VUTZFAOGDXUYEJ-UHFFFAOYSA-N
Compound name
1-[chloro(diphenyl)methyl]-4-methylbenzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

574
Patents

292.10187 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 293.10915 168.6
[M+Na]+ 315.09109 176.3
[M-H]- 291.09459 177.7
[M+NH4]+ 310.13569 184.3
[M+K]+ 331.06503 168.9
[M+H-H2O]+ 275.09913 160.5
[M+HCOO]- 337.10007 186.0
[M+CH3COO]- 351.11572 180.3
[M+Na-2H]- 313.07654 175.1
[M]+ 292.10132 169.3
[M]- 292.10242 169.3
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

No patent data available for this compound.