CID 11942

N,n'-diacetylbenzidine

Structural Information

Molecular Formula
C16H16N2O2
SMILES
CC(=O)NC1=CC=C(C=C1)C2=CC=C(C=C2)NC(=O)C
InChI
InChI=1S/C16H16N2O2/c1-11(19)17-15-7-3-13(4-8-15)14-5-9-16(10-6-14)18-12(2)20/h3-10H,1-2H3,(H,17,19)(H,18,20)
InChIKey
CZVHCFKUXGRABC-UHFFFAOYSA-N
Compound name
N-[4-(4-acetamidophenyl)phenyl]acetamide
Related CIDs

2D Structure

compound 2d structure
5
Annotation Hits

24
References

91
Patents

268.1212 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 269.12848 163.3
[M+Na]+ 291.11042 175.5
[M+NH4]+ 286.15502 170.7
[M+K]+ 307.08436 168.9
[M-H]- 267.11392 168.0
[M+Na-2H]- 289.09587 171.5
[M]+ 268.12065 166.2
[M]- 268.12175 166.2
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