CID 18326012

3,3'-dimethyltriphenylamine

Structural Information

Molecular Formula
C20H19N
SMILES
CC1=CC(=CC=C1)N(C2=CC=CC=C2)C3=CC=CC(=C3)C
InChI
InChI=1S/C20H19N/c1-16-8-6-12-19(14-16)21(18-10-4-3-5-11-18)20-13-7-9-17(2)15-20/h3-15H,1-2H3
InChIKey
ZCAWQFNYHFHEPZ-UHFFFAOYSA-N
Compound name
3-methyl-N-(3-methylphenyl)-N-phenylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

99
Patents

273.15176 Da
Monoisotopic Mass

5.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 274.15904 165.0
[M+Na]+ 296.14098 171.5
[M-H]- 272.14448 175.8
[M+NH4]+ 291.18558 181.0
[M+K]+ 312.11492 166.7
[M+H-H2O]+ 256.14902 155.6
[M+HCOO]- 318.14996 190.1
[M+CH3COO]- 332.16561 177.2
[M+Na-2H]- 294.12643 170.4
[M]+ 273.15121 164.7
[M]- 273.15231 164.7
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

patents stripe