CID 2758248

3,3-difluoroazetidine hydrochloride

Structural Information

Molecular Formula
C3H5F2N
SMILES
C1C(CN1)(F)F
InChI
InChI=1S/C3H5F2N/c4-3(5)1-6-2-3/h6H,1-2H2
InChIKey
QUHVRXKSQHIZNV-UHFFFAOYSA-N
Compound name
3,3-difluoroazetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

6579
Patents

93.03901 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 94.046286 113.1
[M+Na]+ 116.028228 120.7
[M-H]- 92.031734 112.0
[M+NH4]+ 111.072833 130.1
[M+K]+ 132.002168 122.4
[M+H-H2O]+ 76.036270 102.9
[M+HCOO]- 138.037211 131.5
[M+CH3COO]- 152.052861 165.1
[M+Na-2H]- 114.013676 121.0
[M]+ 93.03846142 115.8
[M]- 93.03955858 115.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe