CID 165841412

2,2-difluoro-1-(fluoromethyl)cyclopropan-1-amine hydrochloride

Structural Information

Molecular Formula
C4H6F3N
SMILES
C1C(C1(F)F)(CF)N
InChI
InChI=1S/C4H6F3N/c5-2-3(8)1-4(3,6)7/h1-2,8H2
InChIKey
CPBWUUBILNMNQP-UHFFFAOYSA-N
Compound name
2,2-difluoro-1-(fluoromethyl)cyclopropan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

125.045235 Da
Monoisotopic Mass

0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 126.05251 113.8
[M+Na]+ 148.03445 125.1
[M-H]- 124.03796 115.3
[M+NH4]+ 143.07906 134.5
[M+K]+ 164.00839 124.1
[M+H-H2O]+ 108.04250 108.3
[M+HCOO]- 170.04344 135.2
[M+CH3COO]- 184.05909 176.1
[M+Na-2H]- 146.01990 121.9
[M]+ 125.04469 111.6
[M]- 125.04578 111.6
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

No patent data available for this compound.