CID 105427213

3-(difluoromethyl)oxetan-3-amine

Structural Information

Molecular Formula
C4H7F2NO
SMILES
C1C(CO1)(C(F)F)N
InChI
InChI=1S/C4H7F2NO/c5-3(6)4(7)1-8-2-4/h3H,1-2,7H2
InChIKey
YKHSRUKDCLHZSS-UHFFFAOYSA-N
Compound name
3-(difluoromethyl)oxetan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

17
Patents

123.04957 Da
Monoisotopic Mass

-0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.05685 129.0
[M+Na]+ 146.03879 132.9
[M+NH4]+ 141.08339 133.5
[M+K]+ 162.01273 129.1
[M-H]- 122.04229 126.0
[M+Na-2H]- 144.02424 130.8
[M]+ 123.04902 127.4
[M]- 123.05012 127.4
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