CID 75481665

3-(difluoromethoxy)azetidine

Structural Information

Molecular Formula
C4H7F2NO
SMILES
C1C(CN1)OC(F)F
InChI
InChI=1S/C4H7F2NO/c5-4(6)8-3-1-7-2-3/h3-4,7H,1-2H2
InChIKey
DRBMDELQCZMFKH-UHFFFAOYSA-N
Compound name
3-(difluoromethoxy)azetidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

248
Patents

123.04957 Da
Monoisotopic Mass

0.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 124.05685 120.7
[M+Na]+ 146.03879 126.5
[M-H]- 122.04229 118.8
[M+NH4]+ 141.08339 134.3
[M+K]+ 162.01273 128.8
[M+H-H2O]+ 106.04683 108.6
[M+HCOO]- 168.04777 137.9
[M+CH3COO]- 182.06342 171.1
[M+Na-2H]- 144.02424 125.6
[M]+ 123.04902 124.1
[M]- 123.05012 124.1
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

patents stripe