CID 63363393

N-(2,2,2-trifluoroethyl)oxan-3-amine

Structural Information

Molecular Formula
C7H12F3NO
SMILES
C1CC(COC1)NCC(F)(F)F
InChI
InChI=1S/C7H12F3NO/c8-7(9,10)5-11-6-2-1-3-12-4-6/h6,11H,1-5H2
InChIKey
ZNAJQMXLLJBWBB-UHFFFAOYSA-N
Compound name
N-(2,2,2-trifluoroethyl)oxan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.0871 Da
Monoisotopic Mass

1.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.09438 143.1
[M+Na]+ 206.07632 149.8
[M+NH4]+ 201.12092 149.0
[M+K]+ 222.05026 145.2
[M-H]- 182.07982 141.5
[M+Na-2H]- 204.06177 145.5
[M]+ 183.08655 143.2
[M]- 183.08765 143.2
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.