CID 53621882

2-(3-chlorophenyl)cyclopentan-1-ol

Structural Information

Molecular Formula
C11H13ClO
SMILES
C1CC(C(C1)O)C2=CC(=CC=C2)Cl
InChI
InChI=1S/C11H13ClO/c12-9-4-1-3-8(7-9)10-5-2-6-11(10)13/h1,3-4,7,10-11,13H,2,5-6H2
InChIKey
XBJWMSMUZCFGKY-UHFFFAOYSA-N
Compound name
2-(3-chlorophenyl)cyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

196.06549 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 197.07277 140.6
[M+Na]+ 219.05471 153.9
[M+NH4]+ 214.09931 150.7
[M+K]+ 235.02865 147.9
[M-H]- 195.05821 144.6
[M+Na-2H]- 217.04016 148.0
[M]+ 196.06494 143.9
[M]- 196.06604 143.9
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.