CID 146082148

Ethyl 2-(azetidin-3-ylidene)-2-fluoroacetate hydrochloride

Structural Information

Molecular Formula
C7H10FNO2
SMILES
CCOC(=O)C(=C1CNC1)F
InChI
InChI=1S/C7H10FNO2/c1-2-11-7(10)6(8)5-3-9-4-5/h9H,2-4H2,1H3
InChIKey
ZYPWFPWJCRTXHJ-UHFFFAOYSA-N
Compound name
ethyl 2-(azetidin-3-ylidene)-2-fluoroacetate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

2
Patents

159.06955 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.076826 134.3
[M+Na]+ 182.058768 139.1
[M-H]- 158.062274 133.4
[M+NH4]+ 177.103373 146.3
[M+K]+ 198.032708 140.9
[M+H-H2O]+ 142.066810 122.4
[M+HCOO]- 204.067751 151.1
[M+CH3COO]- 218.083401 176.9
[M+Na-2H]- 180.044216 136.7
[M]+ 159.06900142 139.1
[M]- 159.07009858 139.1
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