CID 47003318

3-(difluoromethoxy)piperidine

Structural Information

Molecular Formula
C6H11F2NO
SMILES
C1CC(CNC1)OC(F)F
InChI
InChI=1S/C6H11F2NO/c7-6(8)10-5-2-1-3-9-4-5/h5-6,9H,1-4H2
InChIKey
RFLBTFBEDGNWFK-UHFFFAOYSA-N
Compound name
3-(difluoromethoxy)piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

24
Patents

151.08087 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 152.088146 130.0
[M+Na]+ 174.070088 134.8
[M-H]- 150.073594 127.1
[M+NH4]+ 169.114693 148.5
[M+K]+ 190.044028 133.5
[M+H-H2O]+ 134.078130 122.0
[M+HCOO]- 196.079071 145.4
[M+CH3COO]- 210.094721 171.7
[M+Na-2H]- 172.055536 133.7
[M]+ 151.08032142 121.5
[M]- 151.08141858 121.5
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