CID 53346593

3-(hydroxymethyl)oxetan-3-ol

Structural Information

Molecular Formula
C4H8O3
SMILES
C1C(CO1)(CO)O
InChI
InChI=1S/C4H8O3/c5-1-4(6)2-7-3-4/h5-6H,1-3H2
InChIKey
TVRBHJADIOFJDI-UHFFFAOYSA-N
Compound name
3-(hydroxymethyl)oxetan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

48
Patents

104.04734 Da
Monoisotopic Mass

-1.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 105.05462 117.1
[M+Na]+ 127.03656 122.6
[M+NH4]+ 122.08116 122.3
[M+K]+ 143.01050 119.5
[M-H]- 103.04006 115.3
[M+Na-2H]- 125.02201 120.1
[M]+ 104.04679 116.1
[M]- 104.04789 116.1
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