CID 21890808

2924-65-4

Structural Information

Molecular Formula
C8H9FO2
SMILES
C1=CC=C(C(=C1)OCCO)F
InChI
InChI=1S/C8H9FO2/c9-7-3-1-2-4-8(7)11-6-5-10/h1-4,10H,5-6H2
InChIKey
URVPAMCKEWBRNW-UHFFFAOYSA-N
Compound name
2-(2-fluorophenoxy)ethanol
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

88
Patents

156.05865 Da
Monoisotopic Mass

1.5
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 157.06593 128.2
[M+Na]+ 179.04787 136.6
[M-H]- 155.05137 129.5
[M+NH4]+ 174.09247 148.8
[M+K]+ 195.02181 134.7
[M+H-H2O]+ 139.05591 122.1
[M+HCOO]- 201.05685 151.1
[M+CH3COO]- 215.07250 173.5
[M+Na-2H]- 177.03332 135.3
[M]+ 156.05810 128.1
[M]- 156.05920 128.1
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe