CID 155978325

1-[6-(trifluoromethyl)pyridin-3-yl]cyclobutan-1-amine hydrochloride

Structural Information

Molecular Formula
C10H11F3N2
SMILES
C1CC(C1)(C2=CN=C(C=C2)C(F)(F)F)N
InChI
InChI=1S/C10H11F3N2/c11-10(12,13)8-3-2-7(6-15-8)9(14)4-1-5-9/h2-3,6H,1,4-5,14H2
InChIKey
JBWBMKXEQGNLJQ-UHFFFAOYSA-N
Compound name
1-[6-(trifluoromethyl)-3-pyridinyl]cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

216.08743 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 217.094706 146.7
[M+Na]+ 239.076648 153.9
[M-H]- 215.080154 147.9
[M+NH4]+ 234.121253 159.0
[M+K]+ 255.050588 153.4
[M+H-H2O]+ 199.084690 132.9
[M+HCOO]- 261.085631 163.5
[M+CH3COO]- 275.101281 191.0
[M+Na-2H]- 237.062096 152.1
[M]+ 216.08688142 148.2
[M]- 216.08797858 148.2
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.