CID 165908891

{4-fluoro-2-oxabicyclo[2.2.1]heptan-1-yl}methanol

Structural Information

Molecular Formula
C7H11FO2
SMILES
C1CC2(CC1(CO2)F)CO
InChI
InChI=1S/C7H11FO2/c8-6-1-2-7(3-6,4-9)10-5-6/h9H,1-5H2
InChIKey
YAGZKPIIIAGHJZ-UHFFFAOYSA-N
Compound name
(4-fluoro-2-oxabicyclo[2.2.1]heptan-1-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

146.07431 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 147.08159 127.6
[M+Na]+ 169.06353 136.1
[M-H]- 145.06703 128.7
[M+NH4]+ 164.10813 155.9
[M+K]+ 185.03747 135.2
[M+H-H2O]+ 129.07157 124.4
[M+HCOO]- 191.07251 146.5
[M+CH3COO]- 205.08816 169.0
[M+Na-2H]- 167.04898 135.4
[M]+ 146.07376 125.9
[M]- 146.07486 125.9
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.