CID 113001370

Dtxsid401024839

Structural Information

Molecular Formula
C12H15Cl2N3O2
SMILES
CC(C)NC(=O)NCC(=O)NC1=CC(=CC(=C1)Cl)Cl
InChI
InChI=1S/C12H15Cl2N3O2/c1-7(2)16-12(19)15-6-11(18)17-10-4-8(13)3-9(14)5-10/h3-5,7H,6H2,1-2H3,(H,17,18)(H2,15,16,19)
InChIKey
LGZHPMWZVIUJTN-UHFFFAOYSA-N
Compound name
N-(3,5-dichlorophenyl)-2-(propan-2-ylcarbamoylamino)acetamide
Related CIDs

2D Structure

compound 2d structure
4
Annotation Hits

0
References

0
Patents

303.05414 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 304.06142 168.3
[M+Na]+ 326.04336 174.8
[M-H]- 302.04686 171.4
[M+NH4]+ 321.08796 184.0
[M+K]+ 342.01730 170.1
[M+H-H2O]+ 286.05140 163.4
[M+HCOO]- 348.05234 183.4
[M+CH3COO]- 362.06799 208.8
[M+Na-2H]- 324.02881 169.3
[M]+ 303.05359 170.6
[M]- 303.05469 170.6
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

No patent data available for this compound.