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

1
Patents

137.06522 Da
Monoisotopic Mass

0.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 138.07250 123.7
[M+Na]+ 160.05444 130.8
[M-H]- 136.05794 124.9
[M+NH4]+ 155.09904 145.5
[M+K]+ 176.02838 131.0
[M+H-H2O]+ 120.06248 117.5
[M+HCOO]- 182.06342 142.8
[M+CH3COO]- 196.07907 172.5
[M+Na-2H]- 158.03989 130.5
[M]+ 137.06467 116.5
[M]- 137.06577 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