CID 71756928

3-(difluoromethyl)azetidin-3-ol hydrochloride

Structural Information

Molecular Formula
C4H7F2NO
SMILES
C1C(CN1)(C(F)F)O
InChI
InChI=1S/C4H7F2NO/c5-3(6)4(8)1-7-2-4/h3,7-8H,1-2H2
InChIKey
NSDKIAODRQJVBC-UHFFFAOYSA-N
Compound name
3-(difluoromethyl)azetidin-3-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

8
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 128.6
[M+Na]+ 146.03879 132.3
[M+NH4]+ 141.08339 132.3
[M+K]+ 162.01273 128.5
[M-H]- 122.04229 122.6
[M+Na-2H]- 144.02424 130.0
[M]+ 123.04902 126.0
[M]- 123.05012 126.0
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