CID 3085677

Benzenamine, 4-(1-methyl-1-phenylethyl)-n-phenyl-

Structural Information

Molecular Formula
C21H21N
SMILES
CC(C)(C1=CC=CC=C1)C2=CC=C(C=C2)NC3=CC=CC=C3
InChI
InChI=1S/C21H21N/c1-21(2,17-9-5-3-6-10-17)18-13-15-20(16-14-18)22-19-11-7-4-8-12-19/h3-16,22H,1-2H3
InChIKey
NWCCPBWXLZTMCX-UHFFFAOYSA-N
Compound name
N-phenyl-4-(2-phenylpropan-2-yl)aniline
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

57
Patents

287.1674 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.17468 169.1
[M+Na]+ 310.15662 174.6
[M-H]- 286.16012 178.3
[M+NH4]+ 305.20122 183.8
[M+K]+ 326.13056 168.7
[M+H-H2O]+ 270.16466 160.2
[M+HCOO]- 332.16560 191.8
[M+CH3COO]- 346.18125 180.2
[M+Na-2H]- 308.14207 176.3
[M]+ 287.16685 167.1
[M]- 287.16795 167.1
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.