CID 50989630

1-(trifluoromethyl)cyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula
C5H8F3N
SMILES
C1CC(C1)(C(F)(F)F)N
InChI
InChI=1S/C5H8F3N/c6-5(7,8)4(9)2-1-3-4/h1-3,9H2
InChIKey
UYHQDFQKVUGCAQ-UHFFFAOYSA-N
Compound name
1-(trifluoromethyl)cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

215
Patents

139.06088 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 140.06816 126.7
[M+Na]+ 162.05010 133.4
[M-H]- 138.05360 126.4
[M+NH4]+ 157.09470 143.3
[M+K]+ 178.02404 135.0
[M+H-H2O]+ 122.05814 115.9
[M+HCOO]- 184.05908 144.8
[M+CH3COO]- 198.07473 177.3
[M+Na-2H]- 160.03555 132.8
[M]+ 139.06033 127.7
[M]- 139.06143 127.7
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

No patent data available for this compound.