CID 70153885

1877341-77-9

Structural Information

Molecular Formula
C5H7FO2
SMILES
COC(=O)C1(CC1)F
InChI
InChI=1S/C5H7FO2/c1-8-4(7)5(6)2-3-5/h2-3H2,1H3
InChIKey
KBXVWFDEMAWTBW-UHFFFAOYSA-N
Compound name
methyl 1-fluorocyclopropane-1-carboxylate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

36
Patents

118.04301 Da
Monoisotopic Mass

0.8
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 119.050286 120.5
[M+Na]+ 141.032228 130.8
[M-H]- 117.035734 124.6
[M+NH4]+ 136.076833 140.1
[M+K]+ 157.006168 130.7
[M+H-H2O]+ 101.040270 115.5
[M+HCOO]- 163.041211 143.3
[M+CH3COO]- 177.056861 171.9
[M+Na-2H]- 139.017676 128.0
[M]+ 118.04246142 123.3
[M]- 118.04355858 123.3
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