CID 4991640

N-(2-benzoylphenyl)-2-chloropropanamide

Structural Information

Molecular Formula
C16H14ClNO2
SMILES
CC(C(=O)NC1=CC=CC=C1C(=O)C2=CC=CC=C2)Cl
InChI
InChI=1S/C16H14ClNO2/c1-11(17)16(20)18-14-10-6-5-9-13(14)15(19)12-7-3-2-4-8-12/h2-11H,1H3,(H,18,20)
InChIKey
SOVFDEUNELESDN-UHFFFAOYSA-N
Compound name
N-(2-benzoylphenyl)-2-chloropropanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

287.07132 Da
Monoisotopic Mass

4.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 288.07860 164.1
[M+Na]+ 310.06054 170.5
[M-H]- 286.06404 170.6
[M+NH4]+ 305.10514 179.8
[M+K]+ 326.03448 165.7
[M+H-H2O]+ 270.06858 157.2
[M+HCOO]- 332.06952 182.2
[M+CH3COO]- 346.08517 202.1
[M+Na-2H]- 308.04599 166.7
[M]+ 287.07077 165.5
[M]- 287.07187 165.5
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.