CID 3902225

N-[4-(butan-2-yl)phenyl]biphenyl-4-carboxamide

Structural Information

Molecular Formula
C23H23NO
SMILES
CCC(C)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)C3=CC=CC=C3
InChI
InChI=1S/C23H23NO/c1-3-17(2)18-13-15-22(16-14-18)24-23(25)21-11-9-20(10-12-21)19-7-5-4-6-8-19/h4-17H,3H2,1-2H3,(H,24,25)
InChIKey
OHAXOXOAGAHGQA-UHFFFAOYSA-N
Compound name
N-(4-butan-2-ylphenyl)-4-phenylbenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

329.17798 Da
Monoisotopic Mass

6.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 330.18526 181.6
[M+Na]+ 352.16720 186.2
[M-H]- 328.17070 190.6
[M+NH4]+ 347.21180 194.4
[M+K]+ 368.14114 180.6
[M+H-H2O]+ 312.17524 171.9
[M+HCOO]- 374.17618 203.5
[M+CH3COO]- 388.19183 214.3
[M+Na-2H]- 350.15265 183.8
[M]+ 329.17743 180.5
[M]- 329.17853 180.5
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.