CID 4286128

57844-41-4

Structural Information

Molecular Formula
C28H32N2O2
SMILES
CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C
InChI
InChI=1S/C28H32N2O2/c1-27(2,3)21-11-7-19(8-12-21)25(31)29-23-15-17-24(18-16-23)30-26(32)20-9-13-22(14-10-20)28(4,5)6/h7-18H,1-6H3,(H,29,31)(H,30,32)
InChIKey
BHFXPRVOVPIQGF-UHFFFAOYSA-N
Compound name
4-tert-butyl-N-[4-[(4-tert-butylbenzoyl)amino]phenyl]benzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

428.24637 Da
Monoisotopic Mass

6.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 429.25365 210.4
[M+Na]+ 451.23559 222.6
[M+NH4]+ 446.28019 216.4
[M+K]+ 467.20953 215.5
[M-H]- 427.23909 216.4
[M+Na-2H]- 449.22104 219.4
[M]+ 428.24582 214.0
[M]- 428.24692 214.0
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.