CID 15078444

N-(2-chloroethyl)pyrrolidine-1-carboxamide

Structural Information

Molecular Formula
C7H13ClN2O
SMILES
C1CCN(C1)C(=O)NCCCl
InChI
InChI=1S/C7H13ClN2O/c8-3-4-9-7(11)10-5-1-2-6-10/h1-6H2,(H,9,11)
InChIKey
CSBOTCGEMSFANF-UHFFFAOYSA-N
Compound name
N-(2-chloroethyl)pyrrolidine-1-carboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

176.07164 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 177.07892 139.4
[M+Na]+ 199.06086 145.4
[M-H]- 175.06436 140.8
[M+NH4]+ 194.10546 160.3
[M+K]+ 215.03480 142.9
[M+H-H2O]+ 159.06890 133.4
[M+HCOO]- 221.06984 156.9
[M+CH3COO]- 235.08549 178.0
[M+Na-2H]- 197.04631 142.7
[M]+ 176.07109 137.8
[M]- 176.07219 137.8
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.