CID 130630473

3-[amino(4-fluorophenyl)methyl]oxetan-3-ol

Structural Information

Molecular Formula
C10H12FNO2
SMILES
C1C(CO1)(C(C2=CC=C(C=C2)F)N)O
InChI
InChI=1S/C10H12FNO2/c11-8-3-1-7(2-4-8)9(12)10(13)5-14-6-10/h1-4,9,13H,5-6,12H2
InChIKey
MKKOCEDNJVAEJF-UHFFFAOYSA-N
Compound name
3-[amino-(4-fluorophenyl)methyl]oxetan-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

197.0852 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 198.09248 144.9
[M+Na]+ 220.07442 150.7
[M+NH4]+ 215.11902 149.7
[M+K]+ 236.04836 146.2
[M-H]- 196.07792 145.0
[M+Na-2H]- 218.05987 149.0
[M]+ 197.08465 144.5
[M]- 197.08575 144.5
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.