CID 28805279

1049604-75-2

Structural Information

Molecular Formula
C14H19ClN2O3
SMILES
CCCN(CC(=O)NC1=CC=CC=C1OC)C(=O)CCl
InChI
InChI=1S/C14H19ClN2O3/c1-3-8-17(14(19)9-15)10-13(18)16-11-6-4-5-7-12(11)20-2/h4-7H,3,8-10H2,1-2H3,(H,16,18)
InChIKey
NXCZZJXJRNCFHV-UHFFFAOYSA-N
Compound name
2-[(2-chloroacetyl)-propylamino]-N-(2-methoxyphenyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

298.10843 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 299.11571 168.0
[M+Na]+ 321.09765 177.7
[M+NH4]+ 316.14225 174.3
[M+K]+ 337.07159 172.1
[M-H]- 297.10115 169.5
[M+Na-2H]- 319.08310 172.6
[M]+ 298.10788 169.7
[M]- 298.10898 169.7
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.