CID 54595331

(1s,2s)-2-(difluoromethyl)cyclopropan-1-amine hydrochloride

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
(1S,2S)-2-(difluoromethyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

76
Patents

107.05466 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 108.06194 112.4
[M+Na]+ 130.04388 122.1
[M-H]- 106.04738 114.6
[M+NH4]+ 125.08848 130.1
[M+K]+ 146.01782 120.1
[M+H-H2O]+ 90.051920 105.3
[M+HCOO]- 152.05286 134.6
[M+CH3COO]- 166.06851 174.8
[M+Na-2H]- 128.02933 117.7
[M]+ 107.05411 109.8
[M]- 107.05521 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