CID 63761125

1-(2,2-difluoroethyl)azetidin-3-amine

Structural Information

Molecular Formula
C5H10F2N2
SMILES
C1C(CN1CC(F)F)N
InChI
InChI=1S/C5H10F2N2/c6-5(7)3-9-1-4(8)2-9/h4-5H,1-3,8H2
InChIKey
ZPWBDNIETFFTFF-UHFFFAOYSA-N
Compound name
1-(2,2-difluoroethyl)azetidin-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

136.0812 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 137.088476 128.3
[M+Na]+ 159.070418 134.0
[M-H]- 135.073924 127.4
[M+NH4]+ 154.115023 141.7
[M+K]+ 175.044358 136.2
[M+H-H2O]+ 119.078460 115.4
[M+HCOO]- 181.079401 146.6
[M+CH3COO]- 195.095051 179.7
[M+Na-2H]- 157.055866 131.4
[M]+ 136.08065142 131.0
[M]- 136.08174858 131.0
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

No patent data available for this compound.