CID 218938

Benzeneacetamide, n-(2-acetylphenyl)-

Structural Information

Molecular Formula
C16H15NO2
SMILES
CC(=O)C1=CC=CC=C1NC(=O)CC2=CC=CC=C2
InChI
InChI=1S/C16H15NO2/c1-12(18)14-9-5-6-10-15(14)17-16(19)11-13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,17,19)
InChIKey
BJIHODFICUNNBW-UHFFFAOYSA-N
Compound name
N-(2-acetylphenyl)-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

253.11028 Da
Monoisotopic Mass

3.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 254.117556 158.0
[M+Na]+ 276.099498 163.7
[M-H]- 252.103004 164.5
[M+NH4]+ 271.144103 174.2
[M+K]+ 292.073438 160.2
[M+H-H2O]+ 236.107540 150.1
[M+HCOO]- 298.108481 181.5
[M+CH3COO]- 312.124131 197.5
[M+Na-2H]- 274.084946 162.2
[M]+ 253.10973142 157.5
[M]- 253.11082858 157.5
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