CID 94524

2-chlorotrityl chloride

Structural Information

Molecular Formula
C19H14Cl2
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3Cl)Cl
InChI
InChI=1S/C19H14Cl2/c20-18-14-8-7-13-17(18)19(21,15-9-3-1-4-10-15)16-11-5-2-6-12-16/h1-14H
InChIKey
JFLSOKIMYBSASW-UHFFFAOYSA-N
Compound name
1-chloro-2-[chloro(diphenyl)methyl]benzene
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

34
References

19831
Patents

312.04724 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 313.05452 170.8
[M+Na]+ 335.03646 179.3
[M-H]- 311.03996 179.2
[M+NH4]+ 330.08106 186.1
[M+K]+ 351.01040 171.0
[M+H-H2O]+ 295.04450 163.2
[M+HCOO]- 357.04544 183.3
[M+CH3COO]- 371.06109 182.0
[M+Na-2H]- 333.02191 176.9
[M]+ 312.04669 172.6
[M]- 312.04779 172.6
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