CID 63897715

2089257-13-4

Structural Information

Molecular Formula
C7H12F3NO
SMILES
C1COCCC1C(C(F)(F)F)N
InChI
InChI=1S/C7H12F3NO/c8-7(9,10)6(11)5-1-3-12-4-2-5/h5-6H,1-4,11H2
InChIKey
WCFHFGFGUVXTPA-UHFFFAOYSA-N
Compound name
2,2,2-trifluoro-1-(oxan-4-yl)ethanamine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

183.0871 Da
Monoisotopic Mass

1.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 184.094376 136.9
[M+Na]+ 206.076318 141.6
[M-H]- 182.079824 135.8
[M+NH4]+ 201.120923 154.4
[M+K]+ 222.050258 141.4
[M+H-H2O]+ 166.084360 128.8
[M+HCOO]- 228.085301 151.6
[M+CH3COO]- 242.100951 181.3
[M+Na-2H]- 204.061766 140.9
[M]+ 183.08655142 127.1
[M]- 183.08764858 127.1
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.