CID 91277874

(3-fluoro-3-methylcyclobutyl)methanol

Structural Information

Molecular Formula
C6H11FO
SMILES
CC1(CC(C1)CO)F
InChI
InChI=1S/C6H11FO/c1-6(7)2-5(3-6)4-8/h5,8H,2-4H2,1H3
InChIKey
MNPBGQTWHFXYFJ-UHFFFAOYSA-N
Compound name
(3-fluoro-3-methylcyclobutyl)methanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

5
Patents

118.07939 Da
Monoisotopic Mass

0.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 119.08667 121.7
[M+Na]+ 141.06861 128.8
[M-H]- 117.07211 123.3
[M+NH4]+ 136.11321 139.3
[M+K]+ 157.04255 130.6
[M+H-H2O]+ 101.07665 113.1
[M+HCOO]- 163.07759 141.6
[M+CH3COO]- 177.09324 171.6
[M+Na-2H]- 139.05406 127.9
[M]+ 118.07884 127.8
[M]- 118.07994 127.8
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