CID 15239181

4,4-difluorobut-3-en-1-aminehydrochloride

Structural Information

Molecular Formula
C4H7F2N
SMILES
C(CN)C=C(F)F
InChI
InChI=1S/C4H7F2N/c5-4(6)2-1-3-7/h2H,1,3,7H2
InChIKey
LRWMZMQXLKUXAD-UHFFFAOYSA-N
Compound name
4,4-difluorobut-3-en-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

37
Patents

107.05466 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 108.06194 118.0
[M+Na]+ 130.04388 125.4
[M-H]- 106.04738 115.4
[M+NH4]+ 125.08848 140.4
[M+K]+ 146.01782 124.3
[M+H-H2O]+ 90.051920 111.9
[M+HCOO]- 152.05286 139.9
[M+CH3COO]- 166.06851 169.9
[M+Na-2H]- 128.02933 122.9
[M]+ 107.05411 112.8
[M]- 107.05521 112.8
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