CID 89914

4-tritylaniline

Structural Information

Molecular Formula
C25H21N
SMILES
C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)N
InChI
InChI=1S/C25H21N/c26-24-18-16-23(17-19-24)25(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-19H,26H2
InChIKey
XYHDHXBLSLSXSR-UHFFFAOYSA-N
Compound name
4-tritylaniline
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

154
Patents

335.1674 Da
Monoisotopic Mass

6.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 336.17468 186.5
[M+Na]+ 358.15662 204.5
[M+NH4]+ 353.20122 196.8
[M+K]+ 374.13056 193.1
[M-H]- 334.16012 197.4
[M+Na-2H]- 356.14207 202.2
[M]+ 335.16685 192.7
[M]- 335.16795 192.7
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