CID 5152387

161032-48-0

Structural Information

Molecular Formula
C22H23N
SMILES
CC(C)(C)C1=CC(=C(C(=C1)C2=CC=CC=C2)N)C3=CC=CC=C3
InChI
InChI=1S/C22H23N/c1-22(2,3)18-14-19(16-10-6-4-7-11-16)21(23)20(15-18)17-12-8-5-9-13-17/h4-15H,23H2,1-3H3
InChIKey
QDADOVYTWGTHOZ-UHFFFAOYSA-N
Compound name
4-tert-butyl-2,6-diphenylaniline
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

114
Patents

301.18304 Da
Monoisotopic Mass

6.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 302.19032 174.8
[M+Na]+ 324.17226 181.8
[M-H]- 300.17576 184.2
[M+NH4]+ 319.21686 189.4
[M+K]+ 340.14620 175.5
[M+H-H2O]+ 284.18030 166.1
[M+HCOO]- 346.18124 196.5
[M+CH3COO]- 360.19689 209.4
[M+Na-2H]- 322.15771 178.9
[M]+ 301.18249 172.9
[M]- 301.18359 172.9
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