CID 83814958

3-fluoro-3-methylbutan-1-amine hydrochloride

Structural Information

Molecular Formula
C5H12FN
SMILES
CC(C)(CCN)F
InChI
InChI=1S/C5H12FN/c1-5(2,6)3-4-7/h3-4,7H2,1-2H3
InChIKey
PUAGMMGBTMAYQO-UHFFFAOYSA-N
Compound name
3-fluoro-3-methylbutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

16
Patents

105.095375 Da
Monoisotopic Mass

0.6
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 106.10265 121.0
[M+Na]+ 128.08459 128.3
[M-H]- 104.08810 119.8
[M+NH4]+ 123.12920 143.8
[M+K]+ 144.05853 127.9
[M+H-H2O]+ 88.092635 116.3
[M+HCOO]- 150.09358 142.9
[M+CH3COO]- 164.10923 171.3
[M+Na-2H]- 126.07004 127.8
[M]+ 105.09483 118.4
[M]- 105.09592 118.4
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