CID 89188624

(2z)-3-cyclopropyl-2-fluoroprop-2-enoic acid

Structural Information

Molecular Formula
C6H7FO2
SMILES
C1CC1/C=C(/C(=O)O)\F
InChI
InChI=1S/C6H7FO2/c7-5(6(8)9)3-4-1-2-4/h3-4H,1-2H2,(H,8,9)/b5-3-
InChIKey
DNMPLTOFLDHJDO-HYXAFXHYSA-N
Compound name
(Z)-3-cyclopropyl-2-fluoroprop-2-enoic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

23
Patents

130.04301 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 131.05029 121.9
[M+Na]+ 153.03223 130.8
[M-H]- 129.03573 124.1
[M+NH4]+ 148.07683 138.2
[M+K]+ 169.00617 128.4
[M+H-H2O]+ 113.04027 115.8
[M+HCOO]- 175.04121 142.5
[M+CH3COO]- 189.05686 172.6
[M+Na-2H]- 151.01768 126.3
[M]+ 130.04246 121.6
[M]- 130.04356 121.6
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