CID 53686764

3-methoxyoxan-4-ol

Structural Information

Molecular Formula
C6H12O3
SMILES
COC1COCCC1O
InChI
InChI=1S/C6H12O3/c1-8-6-4-9-3-2-5(6)7/h5-7H,2-4H2,1H3
InChIKey
KOUUNQQSIGKNIA-UHFFFAOYSA-N
Compound name
3-methoxyoxan-4-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10
Patents

132.07864 Da
Monoisotopic Mass

-0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.08592 125.1
[M+Na]+ 155.06786 135.7
[M+NH4]+ 150.11246 133.5
[M+K]+ 171.04180 131.3
[M-H]- 131.07136 127.4
[M+Na-2H]- 153.05331 129.3
[M]+ 132.07809 127.0
[M]- 132.07919 127.0
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