CID 2402156

4791-22-4

Structural Information

Molecular Formula
C4H7ClN2O2
SMILES
CNC(=O)NC(=O)CCl
InChI
InChI=1S/C4H7ClN2O2/c1-6-4(9)7-3(8)2-5/h2H2,1H3,(H2,6,7,8,9)
InChIKey
HZVMNAXEPPKXLS-UHFFFAOYSA-N
Compound name
2-chloro-N-(methylcarbamoyl)acetamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

150.0196 Da
Monoisotopic Mass

-0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 151.02688 127.9
[M+Na]+ 173.00882 136.5
[M+NH4]+ 168.05342 134.8
[M+K]+ 188.98276 132.5
[M-H]- 149.01232 127.0
[M+Na-2H]- 170.99427 131.0
[M]+ 150.01905 128.6
[M]- 150.02015 128.6
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

patents stripe