CID 80133737

1909288-49-8

Structural Information

Molecular Formula
C11H12F3NO
SMILES
C1C(CC1N)C2=CC(=CC=C2)OC(F)(F)F
InChI
InChI=1S/C11H12F3NO/c12-11(13,14)16-10-3-1-2-7(6-10)8-4-9(15)5-8/h1-3,6,8-9H,4-5,15H2
InChIKey
QFLYGBCWLKOUTA-UHFFFAOYSA-N
Compound name
3-[3-(trifluoromethoxy)phenyl]cyclobutan-1-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

231.0871 Da
Monoisotopic Mass

2.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 232.09438 158.5
[M+Na]+ 254.07632 163.0
[M+NH4]+ 249.12092 160.8
[M+K]+ 270.05026 159.1
[M-H]- 230.07982 154.9
[M+Na-2H]- 252.06177 160.2
[M]+ 231.08655 156.8
[M]- 231.08765 156.8
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.