CID 16226968

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

Structural Information

Molecular Formula
C10H11Cl2NO
SMILES
CC(C(=O)NCC1=CC=C(C=C1)Cl)Cl
InChI
InChI=1S/C10H11Cl2NO/c1-7(11)10(14)13-6-8-2-4-9(12)5-3-8/h2-5,7H,6H2,1H3,(H,13,14)
InChIKey
MXIKGEWWJHHSHX-UHFFFAOYSA-N
Compound name
2-chloro-N-[(4-chlorophenyl)methyl]propanamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

4
Patents

231.02177 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.02905 147.3
[M+Na]+ 254.01099 160.4
[M+NH4]+ 249.05559 156.0
[M+K]+ 269.98493 153.1
[M-H]- 230.01449 149.6
[M+Na-2H]- 251.99644 154.0
[M]+ 231.02122 150.3
[M]- 231.02232 150.3
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

patents stripe