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]+ 137.08848 128.3
[M+Na]+ 159.07042 134.0
[M-H]- 135.07392 127.4
[M+NH4]+ 154.11502 141.7
[M+K]+ 175.04436 136.2
[M+H-H2O]+ 119.07846 115.4
[M+HCOO]- 181.07940 146.6
[M+CH3COO]- 195.09505 179.7
[M+Na-2H]- 157.05587 131.4
[M]+ 136.08065 131.0
[M]- 136.08175 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.