CID 21072530

1426309-49-0

Structural Information

Molecular Formula
C4H7F2N
SMILES
C1C(C1(F)F)CN
InChI
InChI=1S/C4H7F2N/c5-4(6)1-3(4)2-7/h3H,1-2,7H2
InChIKey
ISMZEPBEQCSYFX-UHFFFAOYSA-N
Compound name
(2,2-difluorocyclopropyl)methanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

95
Patents

107.05466 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 108.06194 112.8
[M+Na]+ 130.04388 123.5
[M-H]- 106.04738 115.4
[M+NH4]+ 125.08848 132.5
[M+K]+ 146.01782 122.1
[M+H-H2O]+ 90.051920 107.1
[M+HCOO]- 152.05286 135.6
[M+CH3COO]- 166.06851 173.5
[M+Na-2H]- 128.02933 120.4
[M]+ 107.05411 111.3
[M]- 107.05521 111.3
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