CID 44144810

Benzenamine, 4,4'-((2-chlorophenyl)methylene)bis(2-methyl-

Structural Information

Molecular Formula
C21H21ClN2
SMILES
CC1=C(C=CC(=C1)C(C2=CC(=C(C=C2)N)C)C3=CC=CC=C3Cl)N
InChI
InChI=1S/C21H21ClN2/c1-13-11-15(7-9-19(13)23)21(17-5-3-4-6-18(17)22)16-8-10-20(24)14(2)12-16/h3-12,21H,23-24H2,1-2H3
InChIKey
LVTVHAYOZXMKLD-UHFFFAOYSA-N
Compound name
4-[(4-amino-3-methylphenyl)-(2-chlorophenyl)methyl]-2-methylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

336.1393 Da
Monoisotopic Mass

5.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 337.14658 183.3
[M+Na]+ 359.12852 191.7
[M-H]- 335.13202 192.4
[M+NH4]+ 354.17312 197.1
[M+K]+ 375.10246 183.8
[M+H-H2O]+ 319.13656 175.1
[M+HCOO]- 381.13750 201.7
[M+CH3COO]- 395.15315 193.9
[M+Na-2H]- 357.11397 183.3
[M]+ 336.13875 182.8
[M]- 336.13985 182.8
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.