CID 55295258

1-cyclobutyl-2,2,2-trifluoroethan-1-amine hydrochloride

Structural Information

Molecular Formula
C6H10F3N
SMILES
C1CC(C1)C(C(F)(F)F)N
InChI
InChI=1S/C6H10F3N/c7-6(8,9)5(10)4-2-1-3-4/h4-5H,1-3,10H2
InChIKey
LXAOKYBECWRFMX-UHFFFAOYSA-N
Compound name
1-cyclobutyl-2,2,2-trifluoroethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

15
Patents

153.07654 Da
Monoisotopic Mass

1.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 154.08382 131.7
[M+Na]+ 176.06576 136.7
[M-H]- 152.06926 130.8
[M+NH4]+ 171.11036 145.6
[M+K]+ 192.03970 138.5
[M+H-H2O]+ 136.07380 119.2
[M+HCOO]- 198.07474 148.4
[M+CH3COO]- 212.09039 181.5
[M+Na-2H]- 174.05121 134.8
[M]+ 153.07599 132.0
[M]- 153.07709 132.0
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