CID 138040220

2247106-88-1

Structural Information

Molecular Formula
C19H16ClN
SMILES
C1=CC=C(C=C1)C2=CC(=CC=C2)C(C3=CC=C(C=C3)Cl)N
InChI
InChI=1S/C19H16ClN/c20-18-11-9-15(10-12-18)19(21)17-8-4-7-16(13-17)14-5-2-1-3-6-14/h1-13,19H,21H2
InChIKey
RQVTUXPLVJGXIM-UHFFFAOYSA-N
Compound name
(4-chlorophenyl)-(3-phenylphenyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

293.09714 Da
Monoisotopic Mass

5.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 294.10442 168.4
[M+Na]+ 316.08636 175.8
[M-H]- 292.08986 177.2
[M+NH4]+ 311.13096 183.6
[M+K]+ 332.06030 168.3
[M+H-H2O]+ 276.09440 160.3
[M+HCOO]- 338.09534 187.2
[M+CH3COO]- 352.11099 179.8
[M+Na-2H]- 314.07181 172.4
[M]+ 293.09659 167.5
[M]- 293.09769 167.5
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.