CID 15239181

4,4-difluorobut-3-en-1-amine hydrochloride

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

47
Patents

107.05466 Da
Monoisotopic Mass

0.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 108.061936 118.0
[M+Na]+ 130.043878 125.4
[M-H]- 106.047384 115.4
[M+NH4]+ 125.088483 140.4
[M+K]+ 146.017818 124.3
[M+H-H2O]+ 90.051920 111.9
[M+HCOO]- 152.052861 139.9
[M+CH3COO]- 166.068511 169.9
[M+Na-2H]- 128.029326 122.9
[M]+ 107.05411142 112.8
[M]- 107.05520858 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