CID 16226991

2-chloro-n-[(4-fluorophenyl)methyl]propanamide

Structural Information

Molecular Formula
C10H11ClFNO
SMILES
CC(C(=O)NCC1=CC=C(C=C1)F)Cl
InChI
InChI=1S/C10H11ClFNO/c1-7(11)10(14)13-6-8-2-4-9(12)5-3-8/h2-5,7H,6H2,1H3,(H,13,14)
InChIKey
NIECYTLHZCSRKB-UHFFFAOYSA-N
Compound name
2-chloro-N-[(4-fluorophenyl)methyl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

215.05132 Da
Monoisotopic Mass

2.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 216.05860 143.2
[M+Na]+ 238.04054 154.7
[M+NH4]+ 233.08514 151.1
[M+K]+ 254.01448 148.3
[M-H]- 214.04404 144.1
[M+Na-2H]- 236.02599 149.2
[M]+ 215.05077 145.2
[M]- 215.05187 145.2
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.