CID 220164

Cyclopent-2-en-1-ol

Structural Information

Molecular Formula
C5H8O
SMILES
C1CC(C=C1)O
InChI
InChI=1S/C5H8O/c6-5-3-1-2-4-5/h1,3,5-6H,2,4H2
InChIKey
PSBABBDEUFNFKJ-UHFFFAOYSA-N
Compound name
cyclopent-2-en-1-ol
Related CIDs

2D Structure

compound 2d structure
3
Annotation Hits

1
References

1659
Patents

84.05752 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 85.064796 113.9
[M+Na]+ 107.046738 121.5
[M-H]- 83.050244 116.3
[M+NH4]+ 102.091343 138.8
[M+K]+ 123.020678 120.7
[M+H-H2O]+ 67.054780 109.6
[M+HCOO]- 129.055721 137.7
[M+CH3COO]- 143.071371 159.1
[M+Na-2H]- 105.032186 120.5
[M]+ 84.05697142 111.1
[M]- 84.05806858 111.1
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