CID 84106860

(2,2-difluorobutyl)(methyl)aminehydrochloride

Structural Information

Molecular Formula
C5H11F2N
SMILES
CCC(CNC)(F)F
InChI
InChI=1S/C5H11F2N/c1-3-5(6,7)4-8-2/h8H,3-4H2,1-2H3
InChIKey
XQBSVGMGQLFUGE-UHFFFAOYSA-N
Compound name
2,2-difluoro-N-methylbutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

123.08595 Da
Monoisotopic Mass

1.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.09323 123.0
[M+Na]+ 146.07517 130.3
[M-H]- 122.07867 120.9
[M+NH4]+ 141.11977 145.3
[M+K]+ 162.04911 129.9
[M+H-H2O]+ 106.08321 117.2
[M+HCOO]- 168.08415 144.5
[M+CH3COO]- 182.09980 174.8
[M+Na-2H]- 144.06062 130.3
[M]+ 123.08540 120.1
[M]- 123.08650 120.1
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.