CID 12421730

4,4'-(phenylmethylene)bis(n-methylaniline)

Structural Information

Molecular Formula
C21H22N2
SMILES
CNC1=CC=C(C=C1)C(C2=CC=CC=C2)C3=CC=C(C=C3)NC
InChI
InChI=1S/C21H22N2/c1-22-19-12-8-17(9-13-19)21(16-6-4-3-5-7-16)18-10-14-20(23-2)15-11-18/h3-15,21-23H,1-2H3
InChIKey
OPQNVMBGRKGHPG-UHFFFAOYSA-N
Compound name
N-methyl-4-[[4-(methylamino)phenyl]-phenylmethyl]aniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
Patents

302.17828 Da
Monoisotopic Mass

5.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 303.185556 172.9
[M+Na]+ 325.167498 177.6
[M-H]- 301.171004 182.0
[M+NH4]+ 320.212103 186.6
[M+K]+ 341.141438 171.8
[M+H-H2O]+ 285.175540 163.3
[M+HCOO]- 347.176481 197.1
[M+CH3COO]- 361.192131 183.4
[M+Na-2H]- 323.152946 177.9
[M]+ 302.17773142 170.5
[M]- 302.17882858 170.5
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