CID 73553650

1418199-66-2

Structural Information

Molecular Formula
C5H9F2NO
SMILES
C1COCC(C1(F)F)N
InChI
InChI=1S/C5H9F2NO/c6-5(7)1-2-9-3-4(5)8/h4H,1-3,8H2
InChIKey
LSGKYSUJOFSICL-UHFFFAOYSA-N
Compound name
4,4-difluorooxan-3-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

3
Patents

137.06522 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.072496 123.7
[M+Na]+ 160.054438 130.8
[M-H]- 136.057944 124.9
[M+NH4]+ 155.099043 145.5
[M+K]+ 176.028378 131.0
[M+H-H2O]+ 120.062480 117.5
[M+HCOO]- 182.063421 142.8
[M+CH3COO]- 196.079071 172.5
[M+Na-2H]- 158.039886 130.5
[M]+ 137.06467142 116.5
[M]- 137.06576858 116.5
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

patents stripe