CID 781623

N-(3,4-dichlorophenyl)pyrrolidine-1-carboxamide

Structural Information

Molecular Formula
C11H12Cl2N2O
SMILES
C1CCN(C1)C(=O)NC2=CC(=C(C=C2)Cl)Cl
InChI
InChI=1S/C11H12Cl2N2O/c12-9-4-3-8(7-10(9)13)14-11(16)15-5-1-2-6-15/h3-4,7H,1-2,5-6H2,(H,14,16)
InChIKey
CGYRALALOIPHLN-UHFFFAOYSA-N
Compound name
N-(3,4-dichlorophenyl)pyrrolidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

258.03265 Da
Monoisotopic Mass

3.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 259.03993 154.0
[M+Na]+ 281.02187 166.5
[M+NH4]+ 276.06647 162.6
[M+K]+ 296.99581 160.7
[M-H]- 257.02537 157.1
[M+Na-2H]- 279.00732 160.6
[M]+ 258.03210 157.0
[M]- 258.03320 157.0
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.