CID 5289103

(3r,5s)-5-(hydroxymethyl)tetrahydrofuran-3-ol

Structural Information

Molecular Formula
C5H10O3
SMILES
C1[C@H](CO[C@@H]1CO)O
InChI
InChI=1S/C5H10O3/c6-2-5-1-4(7)3-8-5/h4-7H,1-3H2/t4-,5+/m1/s1
InChIKey
WDMXOLOBWMBITN-UHNVWZDZSA-N
Compound name
(3R,5S)-5-(hydroxymethyl)oxolan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

1
References

53
Patents

118.062996 Da
Monoisotopic Mass

-1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 119.07027 121.7
[M+Na]+ 141.05221 128.6
[M-H]- 117.05572 123.1
[M+NH4]+ 136.09682 143.3
[M+K]+ 157.02615 128.8
[M+H-H2O]+ 101.06026 117.5
[M+HCOO]- 163.06120 142.0
[M+CH3COO]- 177.07685 161.9
[M+Na-2H]- 139.03766 127.2
[M]+ 118.06245 119.4
[M]- 118.06354 119.4
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

No patent data available for this compound.