CID 3706346

2-chloro-n-(4-fluorophenyl)-2-phenylacetamide

Structural Information

Molecular Formula

C₁₄H₁₁ClFNO

SMILES

C1=CC=C(C=C1)C(C(=O)NC2=CC=C(C=C2)F)Cl

InChI

InChI=1S/C14H11ClFNO/c15-13(10-4-2-1-3-5-10)14(18)17-12-8-6-11(16)7-9-12/h1-9,13H,(H,17,18)

InChIKey

CKIBHCYSNPWRKS-UHFFFAOYSA-N

Compound name

2-chloro-N-(4-fluorophenyl)-2-phenylacetamide

Related CIDs

2D Structure

compound 2d structure

1
Annotation Hits: 0
References: 0
Patents: 263.05133 Da
Monoisotopic Mass: 3.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Å²) per adduct calculated using CCSbase.
Adduct	m/z	Predicted CCS (Å²)
[M+H]+	264.058606	155.6
[M+Na]+	286.040548	162.9
[M-H]-	262.044054	160.7
[M+NH4]+	281.085153	172.4
[M+K]+	302.014488	157.5
[M+H-H2O]+	246.048590	148.0
[M+HCOO]-	308.049531	173.8
[M+CH3COO]-	322.065181	196.7
[M+Na-2H]-	284.025996	159.8
[M]+	263.05078142	155.0
[M]-	263.05187858	155.0

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.