CID 69833

2-cyclopentylethanol

Structural Information

Molecular Formula
C7H14O
SMILES
C1CCC(C1)CCO
InChI
InChI=1S/C7H14O/c8-6-5-7-3-1-2-4-7/h7-8H,1-6H2
InChIKey
JEXQWCBPEWHFKC-UHFFFAOYSA-N
Compound name
2-cyclopentylethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1936
Patents

114.10446 Da
Monoisotopic Mass

2.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 115.11174 125.1
[M+Na]+ 137.09368 134.5
[M+NH4]+ 132.13828 134.3
[M+K]+ 153.06762 130.3
[M-H]- 113.09718 126.2
[M+Na-2H]- 135.07913 129.5
[M]+ 114.10391 126.5
[M]- 114.10501 126.5
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