CID 101666

(2,2,3,3-tetrafluorocyclobutyl)methanol

Structural Information

Molecular Formula
C5H6F4O
SMILES
C1C(C(C1(F)F)(F)F)CO
InChI
InChI=1S/C5H6F4O/c6-4(7)1-3(2-10)5(4,8)9/h3,10H,1-2H2
InChIKey
DIXNZPIYNXRZEQ-UHFFFAOYSA-N
Compound name
(2,2,3,3-tetrafluorocyclobutyl)methanol
Related CIDs

2D Structure

compound 2d structure
2
Annotation Hits

0
References

27
Patents

158.03548 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 159.04276 145.3
[M+Na]+ 181.02470 148.8
[M+NH4]+ 176.06930 149.2
[M+K]+ 196.99864 142.5
[M-H]- 157.02820 138.5
[M+Na-2H]- 179.01015 146.7
[M]+ 158.03493 142.8
[M]- 158.03603 142.8
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