CID 146082148

En300-7537287

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

0
Patents

159.06955 Da
Monoisotopic Mass

-0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 160.07683 134.3
[M+Na]+ 182.05877 139.1
[M-H]- 158.06227 133.4
[M+NH4]+ 177.10337 146.3
[M+K]+ 198.03271 140.9
[M+H-H2O]+ 142.06681 122.4
[M+HCOO]- 204.06775 151.1
[M+CH3COO]- 218.08340 176.9
[M+Na-2H]- 180.04422 136.7
[M]+ 159.06900 139.1
[M]- 159.07010 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

No patent data available for this compound.