CID 137951534

5-fluoro-2,2-dimethylcyclopentan-1-ol

Structural Information

Molecular Formula
C7H13FO
SMILES
CC1(CCC(C1O)F)C
InChI
InChI=1S/C7H13FO/c1-7(2)4-3-5(8)6(7)9/h5-6,9H,3-4H2,1-2H3
InChIKey
QRGNCPPWBPTECX-UHFFFAOYSA-N
Compound name
5-fluoro-2,2-dimethylcyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

132.09505 Da
Monoisotopic Mass

1.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 133.10233 124.9
[M+Na]+ 155.08427 133.4
[M-H]- 131.08777 126.3
[M+NH4]+ 150.12887 150.4
[M+K]+ 171.05821 132.0
[M+H-H2O]+ 115.09231 120.9
[M+HCOO]- 177.09325 145.6
[M+CH3COO]- 191.10890 170.0
[M+Na-2H]- 153.06972 128.9
[M]+ 132.09450 121.3
[M]- 132.09560 121.3
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.