CID 17164604

N-(3-chloropropyl)cyclopentanecarboxamide

Structural Information

Molecular Formula
C9H16ClNO
SMILES
C1CCC(C1)C(=O)NCCCCl
InChI
InChI=1S/C9H16ClNO/c10-6-3-7-11-9(12)8-4-1-2-5-8/h8H,1-7H2,(H,11,12)
InChIKey
IOMKVYIOXBVQCV-UHFFFAOYSA-N
Compound name
N-(3-chloropropyl)cyclopentanecarboxamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

189.09204 Da
Monoisotopic Mass

2.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.099316 145.1
[M+Na]+ 212.081258 150.2
[M-H]- 188.084764 147.5
[M+NH4]+ 207.125863 166.7
[M+K]+ 228.055198 147.0
[M+H-H2O]+ 172.089300 139.9
[M+HCOO]- 234.090241 163.1
[M+CH3COO]- 248.105891 182.1
[M+Na-2H]- 210.066706 147.3
[M]+ 189.09149142 143.8
[M]- 189.09258858 143.8
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.