CID 147187

N-benzyl-2-chloro-2-phenylacetamide

Structural Information

Molecular Formula
C15H14ClNO
SMILES
C1=CC=C(C=C1)CNC(=O)C(C2=CC=CC=C2)Cl
InChI
InChI=1S/C15H14ClNO/c16-14(13-9-5-2-6-10-13)15(18)17-11-12-7-3-1-4-8-12/h1-10,14H,11H2,(H,17,18)
InChIKey
PPKWFXHUJIGMNJ-UHFFFAOYSA-N
Compound name
N-benzyl-2-chloro-2-phenylacetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

259.0764 Da
Monoisotopic Mass

3.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 260.08368 158.9
[M+Na]+ 282.06562 173.1
[M+NH4]+ 277.11022 168.1
[M+K]+ 298.03956 164.6
[M-H]- 258.06912 164.1
[M+Na-2H]- 280.05107 168.8
[M]+ 259.07585 162.7
[M]- 259.07695 162.7
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

No patent data available for this compound.