CID 130164271

2-ethenyl-5-fluorophenol

Structural Information

Molecular Formula
C8H7FO
SMILES
C=CC1=C(C=C(C=C1)F)O
InChI
InChI=1S/C8H7FO/c1-2-6-3-4-7(9)5-8(6)10/h2-5,10H,1H2
InChIKey
GMNDMODYHMDINI-UHFFFAOYSA-N
Compound name
2-ethenyl-5-fluorophenol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

1
Patents

138.0481 Da
Monoisotopic Mass

2.4
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 139.055376 122.8
[M+Na]+ 161.037318 132.5
[M-H]- 137.040824 124.6
[M+NH4]+ 156.081923 144.4
[M+K]+ 177.011258 129.6
[M+H-H2O]+ 121.045360 117.4
[M+HCOO]- 183.046301 145.7
[M+CH3COO]- 197.061951 171.7
[M+Na-2H]- 159.022766 129.4
[M]+ 138.04755142 120.9
[M]- 138.04864858 120.9
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