CID 59543144

1-cyclopropyl-2,2-difluoroethan-1-amine hydrochloride

Structural Information

Molecular Formula
C5H9F2N
SMILES
C1CC1C(C(F)F)N
InChI
InChI=1S/C5H9F2N/c6-5(7)4(8)3-1-2-3/h3-5H,1-2,8H2
InChIKey
WXSBBSYRLYANMA-UHFFFAOYSA-N
Compound name
1-cyclopropyl-2,2-difluoroethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

21
Patents

121.070305 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 122.07758 116.8
[M+Na]+ 144.05952 125.1
[M-H]- 120.06303 118.6
[M+NH4]+ 139.10413 133.7
[M+K]+ 160.03346 123.4
[M+H-H2O]+ 104.06756 109.5
[M+HCOO]- 166.06851 137.9
[M+CH3COO]- 180.08416 177.4
[M+Na-2H]- 142.04497 121.2
[M]+ 121.06976 113.7
[M]- 121.07085 113.7
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