CID 54595331

1820573-97-4

Structural Information

Molecular Formula
C4H7F2N
SMILES
C1[C@@H]([C@H]1N)C(F)F
InChI
InChI=1S/C4H7F2N/c5-4(6)2-1-3(2)7/h2-4H,1,7H2/t2-,3-/m0/s1
InChIKey
GAIGMFMTIOWSIT-HRFVKAFMSA-N
Compound name
trans-(1S,2S)-2-(difluoromethyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

51
Patents

107.05466 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 108.061936 112.4
[M+Na]+ 130.043878 122.1
[M-H]- 106.047384 114.6
[M+NH4]+ 125.088483 130.1
[M+K]+ 146.017818 120.1
[M+H-H2O]+ 90.051920 105.3
[M+HCOO]- 152.052861 134.6
[M+CH3COO]- 166.068511 174.8
[M+Na-2H]- 128.029326 117.7
[M]+ 107.05411142 109.8
[M]- 107.05520858 109.8
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