CID 3019960

2-pentylcyclopentan-1-ol

Structural Information

Molecular Formula
C10H20O
SMILES
CCCCCC1CCCC1O
InChI
InChI=1S/C10H20O/c1-2-3-4-6-9-7-5-8-10(9)11/h9-11H,2-8H2,1H3
InChIKey
MWYGSCHWFNRSET-UHFFFAOYSA-N
Compound name
2-pentylcyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

0
References

627
Patents

156.15141 Da
Monoisotopic Mass

3.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.15869 138.7
[M+Na]+ 179.14063 144.0
[M-H]- 155.14413 140.1
[M+NH4]+ 174.18523 160.9
[M+K]+ 195.11457 142.1
[M+H-H2O]+ 139.14867 133.7
[M+HCOO]- 201.14961 159.4
[M+CH3COO]- 215.16526 175.7
[M+Na-2H]- 177.12608 140.9
[M]+ 156.15086 136.7
[M]- 156.15196 136.7
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

patents stripe