CID 78284

Cyclopentanecarbonyl chloride

Structural Information

Molecular Formula
C6H9ClO
SMILES
C1CCC(C1)C(=O)Cl
InChI
InChI=1S/C6H9ClO/c7-6(8)5-3-1-2-4-5/h5H,1-4H2
InChIKey
WEPUZBYKXNKSDH-UHFFFAOYSA-N
Compound name
cyclopentanecarbonyl chloride
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

1
References

5289
Patents

132.0342 Da
Monoisotopic Mass

2.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.041476 126.6
[M+Na]+ 155.023418 133.9
[M-H]- 131.026924 129.7
[M+NH4]+ 150.068023 150.8
[M+K]+ 170.997358 131.6
[M+H-H2O]+ 115.031460 122.5
[M+HCOO]- 177.032401 144.6
[M+CH3COO]- 191.048051 169.1
[M+Na-2H]- 153.008866 130.2
[M]+ 132.03365142 125.0
[M]- 132.03474858 125.0
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