CID 155820052

2470441-26-8

Structural Information

Molecular Formula
C9H14F2O2
SMILES
C1C(CC2COCC1C2(F)F)CO
InChI
InChI=1S/C9H14F2O2/c10-9(11)7-1-6(3-12)2-8(9)5-13-4-7/h6-8,12H,1-5H2
InChIKey
VLOIKODOBYAGOR-UHFFFAOYSA-N
Compound name
(9,9-difluoro-3-oxabicyclo[3.3.1]nonan-7-yl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

192.09619 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 193.10347 138.8
[M+Na]+ 215.08541 145.4
[M-H]- 191.08891 138.0
[M+NH4]+ 210.13001 160.1
[M+K]+ 231.05935 144.1
[M+H-H2O]+ 175.09345 132.6
[M+HCOO]- 237.09439 151.6
[M+CH3COO]- 251.11004 180.5
[M+Na-2H]- 213.07086 145.1
[M]+ 192.09564 132.7
[M]- 192.09674 132.7
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.