CID 83915078

1550959-80-2

Structural Information

Molecular Formula
C7H12F3NO
SMILES
C1CC(CC1CN)(C(F)(F)F)O
InChI
InChI=1S/C7H12F3NO/c8-7(9,10)6(12)2-1-5(3-6)4-11/h5,12H,1-4,11H2
InChIKey
CABSTXAWASUBNA-UHFFFAOYSA-N
Compound name
3-(aminomethyl)-1-(trifluoromethyl)cyclopentan-1-ol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.0871 Da
Monoisotopic Mass

0.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.09438 141.0
[M+Na]+ 206.07632 146.0
[M+NH4]+ 201.12092 147.5
[M+K]+ 222.05026 142.3
[M-H]- 182.07982 136.8
[M+Na-2H]- 204.06177 143.3
[M]+ 183.08655 140.1
[M]- 183.08765 140.1
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.