CID 10844345

2-(oxetan-3-yl)ethanol

Structural Information

Molecular Formula
C5H10O2
SMILES
C1C(CO1)CCO
InChI
InChI=1S/C5H10O2/c6-2-1-5-3-7-4-5/h5-6H,1-4H2
InChIKey
LBOMVZHWFXVFLY-UHFFFAOYSA-N
Compound name
2-(oxetan-3-yl)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

190
Patents

102.06808 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 103.07536 116.7
[M+Na]+ 125.05730 122.9
[M+NH4]+ 120.10190 121.3
[M+K]+ 141.03124 120.3
[M-H]- 101.06080 115.9
[M+Na-2H]- 123.04275 119.0
[M]+ 102.06753 116.0
[M]- 102.06863 116.0
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